SCHEMBL20791990

SCHEMBL20791990

CC(C)COc1ccc(C(C)C)c(F)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.44
MAOB P27338 3/20 0.44
PDK2 Q15119 1/20 0.40
CARM1 Q86X55 1/20 0.40
GPR88 Q9GZN0 1/20 0.39
KMT2A Q03164 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
IDH1 O75874 2/20 0.39
XDH P47989 1/20 0.38
TRIM24 O15164 1/20 0.38
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
XBP1 P17861 1/20 0.37
PDE2A O00408 1/20 0.37
KDM4E B2RXH2 1/20 0.37
FFAR1 O14842 1/20 0.37
PPARD Q03181 1/20 0.37

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
SCHEMBL16046067 0.86 PDE2A (0.47) MAOAMAOBPDK2GPR88IDH1
SCHEMBL19876584 0.86 PDE2A (0.47) MAOAMAOBPDK2GPR88IDH1
SCHEMBL17658878 0.86 MAOA (0.41) MAOAMAOBPDK2CARM1KMT2A
SCHEMBL18119645 0.85 NQO1 (0.48) CARM1KMT2AMAPTHPGDPDE2A
SCHEMBL16997126 0.83 TDP1 (0.50) PDK2CARM1KMT2AL3MBTL1LMNA
SCHEMBL15000540 0.81 CARM1 (0.49) CARM1KMT2AL3MBTL1LMNAPDE2A
SCHEMBL22857118 0.81 CARM1 (0.46) MAOBPDK2CARM1KMT2ALMNA
SCHEMBL19618909 0.81 CARM1 (0.52) PDK2CARM1KMT2AL3MBTL1LMNA
SCHEMBL8137382 0.81 CARM1 (0.39) MAOAMAOBCARM1GPR88KMT2A
SCHEMBL14363223 0.80 FFAR1 (0.45) MAOAMAOBPDK2CARM1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-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

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

For each of this compound's patents that has machine-readable text (3 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-20190194212-A1 Compounds For Reducing c-Myc In c-Myc Overexpressing Cancers Background MYC, MYCBP, BCOR MAOA 3542/4885MAOB 3265/4885PDK2 1477/4885
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 MAOA 4774/4885MAOB 4763/4885PDK2 1985/4885
US-10882863-B2 Compounds for reducing c-Myc in c-Myc overexpressing cancers background MYC, MYCBP, BCOR MAOA 3668/4885MAOB 3372/4885PDK2 1521/4885

“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.