SCHEMBL5018932

SCHEMBL5018932

CC(C)Oc1ccc(C(C)C)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
KMT2A Q03164 1/20 0.41
PTGS1 P23219 2/20 0.41
PTGS2 P35354 2/20 0.41
MAOB P27338 1/20 0.40
PARP10 Q53GL7 1/20 0.40
PDE2A O00408 2/20 0.40
BRD4 O60885 1/20 0.40
BRPF1 P55201 1/20 0.40
ALDH1A3 P47895 1/20 0.38
CPS1 P31327 1/20 0.38
POLB P06746 1/20 0.38
PLA2G1B P04054 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
GLA P06280 1/20 0.37
KAT6A Q92794 1/20 0.37
PDK2 Q15119 1/20 0.36
CARM1 Q86X55 1/20 0.36
KDM4E B2RXH2 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL12883118 0.86 PDE2A (0.42) KMT2APTGS1PTGS2PDE2APOLB
SCHEMBL28790628 0.83 PDE2A (0.41) PTGS1PTGS2PDE2ACARM1
SCHEMBL31063437 0.82 CA12 (0.45) KMT2APTGS1PTGS2MAOBPDE2A
SCHEMBL8241491 0.82 CA12 (0.45) KMT2APTGS1PTGS2MAOBPDE2A
SCHEMBL30829775 0.81 ALDH1A1 (0.47) ALDH1A1KMT2AMAOBPARP10BRD4
SCHEMBL1020456 0.81 ALDH1A1 (0.47) ALDH1A1KMT2AMAOBPARP10BRD4
SCHEMBL12889913 0.81 ALDH1A1 (0.47) ALDH1A1KMT2APARP10BRD4BRPF1
SCHEMBL8589302 0.80 PTGS2 (0.63) ALDH1A1KMT2APTGS1PTGS2PARP10
SCHEMBL9946003 0.79 TDP1 (0.54) ALDH1A1KMT2APARP10BRD4BRPF1
SCHEMBL18119645 0.78 NQO1 (0.48) ALDH1A1KMT2APTGS2PDE2ATDP1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11634425-B2 Pharmaceutical compounds PFIZER INC. (US) 2023-04-25 US disclosed
US-20220162197-A1 MYST FAMILY HISTONE ACETYLTRANSFERASE INHIBITORS Epizyme, Inc. 2022-05-26 US disclosed
WO-2022026823-A1 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CHAN ZUCKERBERG BIOHUB, INC. (US) 2022-02-03 WO disclosed
WO-2021032992-A1 PHARMACEUTICAL COMPOUNDS ReViral Limited (GB) 2021-02-25 WO disclosed
US-10882863-B2 Compounds for reducing c-Myc in c-Myc overexpressing cancers background THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2021-01-05 US disclosed
US-10385070-B2 Chroman-spirocyclic piperidine amides as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-08-20 US disclosed
US-20190194212-A1 Compounds For Reducing c-Myc In c-Myc Overexpressing Cancers Background THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2019-06-27 US disclosed
US-10233191-B2 Fused piperidine amides as modulators of ion channels VERTEX PHARMACEUTICALS INCORPORATED (US) 2019-03-19 US disclosed
US-20190070183-A1 Targeting Casein Kinase-1 and PI3K/AKT/mTOR Pathways for Treatment of c-Myc-Overexpressing Cancers, Organ Transplant Associated Complications and Autoimmune Diseases UNIV COLUMBIA (US) 2019-03-07 US disclosed
US-9796716-B2 Selective inhibitors of Tec and Src protein kinase families PHARMASCIENCE, INC. (CA) 2017-10-24 US disclosed
US-8673925-B1 Tyrosine kinase inhibitors PRINCIPIA BIOPHARMA INC. (US) 2014-03-18 US disclosed
US-20120264749-A1 MORPHOLINE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2012-10-18 US disclosed
US-20120264749-A1 MORPHOLINE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2012-10-18 US disclosed
US-20120245136-A1 CHROMAN-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2012-09-27 US disclosed
US-20120196869-A1 PYRROLOPYRAZINE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED 2012-08-02 US disclosed
US-8178490-B2 Polybasic bacterial efflux pump inhibitors and therapeutic uses thereof REMPEX PHARMACEUTICALS, INC. (US) 2012-05-15 US disclosed
US-8178490-B2 Polybasic bacterial efflux pump inhibitors and therapeutic uses thereof REMPEX PHARMACEUTICALS, INC. (US) 2012-05-15 US disclosed
US-20110306607-A1 HETEROCYCLIC CHROMENE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-12-15 US disclosed
US-20100152098-A1 POLYBASIC BACTERIAL EFFLUX PUMP INHIBITORS AND THERAPEUTIC USES THEREOF MPEX PHARMACEUTICALS, INC. (US) 2010-06-17 US disclosed
US-20100152098-A1 POLYBASIC BACTERIAL EFFLUX PUMP INHIBITORS AND THERAPEUTIC USES THEREOF MPEX PHARMACEUTICALS, INC. (US) 2010-06-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220162197-A1 MYST FAMILY HISTONE ACETYLTRANSFERASE INHIBITORS EP300, KAT2A, KAT6A ALDH1A1 2786/4885KMT2A 33/4885PTGS1 4366/4885
US-20190194212-A1 Compounds For Reducing c-Myc In c-Myc Overexpressing Cancers Background MYC, MYCBP, BCOR ALDH1A1 3356/4885KMT2A 531/4885PTGS1 3937/4885
US-10233191-B2 Fused piperidine amides as modulators of ion channels TRPV1, TRPA1, KCNJ2 ALDH1A1 2307/4885KMT2A 1347/4885PTGS1 434/4885
US-20100152098-A1 POLYBASIC BACTERIAL EFFLUX PUMP INHIBITORS AND THERAPEUTIC USES THEREOF ABCB11, ABCB1, SLC47A1 ALDH1A1 4062/4885KMT2A 3928/4885PTGS1 1965/4885
US-20110306607-A1 HETEROCYCLIC CHROMENE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS KCNJ2, TRPV1, KCNJ1 ALDH1A1 1614/4885KMT2A 2425/4885PTGS1 1061/4885
US-20190070183-A1 Targeting Casein Kinase-1 and PI3K/AKT/mTOR Pathways for Treatment of c-Myc-Overexpressing Cancers, Organ Transplant Associated Complications and Autoimmune Diseases MYC, MTOR, MALT1 ALDH1A1 4822/4885KMT2A 1025/4885PTGS1 3251/4885
US-20120245136-A1 CHROMAN-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS KCNJ2, KCNJ1, KCNC1 ALDH1A1 1764/4885KMT2A 2130/4885PTGS1 1600/4885
US-20120196869-A1 PYRROLOPYRAZINE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS KCNJ2, KCNJ5, KCNJ1 ALDH1A1 1663/4885KMT2A 2577/4885PTGS1 1149/4885
US-20120264749-A1 MORPHOLINE-SPIROCYCLIC PIPERIDINE AMIDES AS MODULATORS OF ION CHANNELS KCNJ2, TRPM5, KCNQ1 ALDH1A1 1738/4885KMT2A 1876/4885PTGS1 1875/4885
US-11634425-B2 Pharmaceutical compounds GABRA6, CHRNA6, CNR1 ALDH1A1 3010/4885KMT2A 3408/4885PTGS1 3543/4885
US-10882863-B2 Compounds for reducing c-Myc in c-Myc overexpressing cancers background MYC, MYCBP, BCOR ALDH1A1 3444/4885KMT2A 548/4885PTGS1 3965/4885
US-10385070-B2 Chroman-spirocyclic piperidine amides as modulators of ion channels KCNJ2, KCNJ1, KCNC1 ALDH1A1 1764/4885KMT2A 2130/4885PTGS1 1600/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.