SCHEMBL179072

SCHEMBL179072

CCn1ccc2ccccc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TNF P01375 1/20 0.55
KDM4E B2RXH2 7/20 0.51
ALDH1A1 P00352 4/20 0.47
KMT2A Q03164 3/20 0.47
TDP1 Q9NUW8 2/20 0.47
MEN1 O00255 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
MAPT P10636 2/20 0.46
PSMB1 P20618 2/20 0.46
PSMB5 P28074 2/20 0.46
NLRP3 Q96P20 1/20 0.46
POLB P06746 1/20 0.45
ACHE P22303 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
BRD4 O60885 1/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL29809320 1.00 TNF (0.55) TNFKDM4EALDH1A1KMT2ATDP1
SCHEMBL28525147 0.85 TNF (0.59) TNFKDM4EKMT2ATDP1MEN1
SCHEMBL29809435 0.85 TNF (0.59) TNFKDM4EKMT2ATDP1MEN1
SCHEMBL29809443 0.82 TNF (0.64) TNFKDM4ETDP1PSMB1PSMB5
SCHEMBL4552574 0.81 TNF (0.63) TNFKDM4ETDP1PSMB1PSMB5
SCHEMBL17407622 0.80 HTR2A (0.54) TNFKDM4EALDH1A1TDP1MAPT
SCHEMBL1758143 0.80 KDM4E (0.51) TNFKDM4EALDH1A1KMT2ATDP1
SCHEMBL1757681 0.80 KDM4E (0.55) TNFKDM4EALDH1A1KMT2ATDP1
SCHEMBL28525351 0.80 TNF (0.61) TNFKDM4ETDP1ACHE
SCHEMBL3519592 0.78 KDM4E (0.46) TNFKDM4EALDH1A1KMT2ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024059249-A1 M4 ACTIVATORS/MODULATORS AND USES THEREOF CEREVEL THERAPEUTICS, LLC (US) 2024-03-21 WO disclosed
US-20230149549-A1 SMARCA DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-05-18 US disclosed
US-20230059865-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING SKYHAWK THERAPEUTICS, INC. 2023-02-23 US disclosed
US-11530408-B2 Therapeutic compositions ALNYLAM PHARMACEUTICALS, INC. (US) 2022-12-20 US disclosed
CN-112876413-B Preparation and antiviral activity of 2- (isoquinoline-1 (2H) -ketone-4-yl) difluoro acetyl derivative 南开大学 2022-10-28 CN disclosed
US-11162101-B2 Methods and compositions for modulating splicing SKYHAWK THERAPEUTICS, INC. (US) 2021-11-02 US disclosed
US-11091475-B2 Methods and compositions for modulating splicing SKYHAWK THERAPEUTICS, INC. (US) 2021-08-17 US disclosed
US-20210171519-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING SKYHAWK THERAPEUTICS, INC. 2021-06-10 US disclosed
US-20200255833-A1 THERAPEUTIC COMPOSITIONS BANK OF AMERICA, N.A. 2020-08-13 US disclosed
US-20200247799-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING SKYHAWK THERAPEUTICS, INC. 2020-08-06 US disclosed
US-20100292455-A1 MODIFIED iRNA AGENTS ALNYLAM PHARMACEUTICALS (US) 2010-11-18 US disclosed
US-20100267810-A1 METHODS AND COMPOSITIONS FOR TREATING NEUROLOGICAL DISEASE UNIVERSITY OF MASSACHUSETTS (US) 2010-10-21 US disclosed
US-20100240881-A1 THERAPEUTIC COMPOSITIONS ALNYLAM PHARMACEUTICALS, INC. (US) 2010-09-23 US disclosed
US-20100160303-A1 CARBAZOLE CARBOXAMIDE COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY 2010-06-24 US disclosed
US-7723509-B2 Conjugated lipophilic group with a modified nucleotide is used to target disease gene, cells, tissue, for drug delivery to target tumor cells; ribose sugar of nucleotide is replaced with a cyclic carrier which has at least one attached phosphate or phosphorothioate group; biodrugs ALNYLAM PHARMACEUTICALS (US) 2010-05-25 US disclosed
US-20100076056-A1 MODIFIED iRNA AGENTS ALNYLAM PHARMACEUTICALS, INC. (US) 2010-03-25 US disclosed
US-20070275914-A1 Therapeutic Compositions BANK OF AMERICA, N.A. 2007-11-29 US disclosed
US-20070179100-A1 Protected monomers ALNYLAM PHARMACEUTICALS, INC. 2007-08-02 US disclosed
US-20070161591-A1 Methods and compositions for treating neurological disease UNIVERSITY OF MASSACHUSETTS (US) 2007-07-12 US disclosed
WO-1994027969-A1 ISOQUINOLINETRIONE DERIVATIVES AS HERBICIDES ZENECA LIMITED (GB) 1994-12-08 WO 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 (16 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-20070161591-A1 Methods and compositions for treating neurological disease SMN1; SMN2, CLN6, INA TNF 1413/4885KDM4E 4076/4885ALDH1A1 2103/4885
US-20100292455-A1 MODIFIED iRNA AGENTS NCL, HNRNPA0, HNRNPA1 TNF 3165/4885KDM4E 4097/4885ALDH1A1 1745/4885
US-20210171519-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING RBM17, SF3B1, SNRPA1 TNF 4612/4885KDM4E 2530/4885ALDH1A1 4181/4885
US-20200247799-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING RBM17, SF3B1, SNRPA1 TNF 4612/4885KDM4E 2530/4885ALDH1A1 4181/4885
US-20100160303-A1 CARBAZOLE CARBOXAMIDE COMPOUNDS USEFUL AS KINASE INHIBITORS BTK, FLT3, JAK1 TNF 3622/4885KDM4E 733/4885ALDH1A1 3832/4885
US-20200255833-A1 THERAPEUTIC COMPOSITIONS SNRPE, HNRNPH3, RNASE1 TNF 3194/4885KDM4E 3864/4885ALDH1A1 3911/4885
US-20230149549-A1 SMARCA DEGRADERS AND USES THEREOF SMARCA1, SMARCB1, SMARCE1 TNF 4285/4885KDM4E 613/4885ALDH1A1 3473/4885
US-20070275914-A1 Therapeutic Compositions AGO2, EXOSC5, RNASE1 TNF 2201/4885KDM4E 1080/4885ALDH1A1 4768/4885
US-20100267810-A1 METHODS AND COMPOSITIONS FOR TREATING NEUROLOGICAL DISEASE SMN1; SMN2, CLN6, INA TNF 1413/4885KDM4E 4076/4885ALDH1A1 2103/4885
US-20100240881-A1 THERAPEUTIC COMPOSITIONS SNRPE, HNRNPH3, RNASE1 TNF 3194/4885KDM4E 3864/4885ALDH1A1 3911/4885
US-11530408-B2 Therapeutic compositions SNRPE, HNRNPH3, RNASE1 TNF 3194/4885KDM4E 3864/4885ALDH1A1 3911/4885
US-20100076056-A1 MODIFIED iRNA AGENTS LDLR, RNASE1, SARNP TNF 2937/4885KDM4E 3860/4885ALDH1A1 2517/4885
US-11162101-B2 Methods and compositions for modulating splicing RBM17, SF3B1, SNRPA1 TNF 4612/4885KDM4E 2530/4885ALDH1A1 4181/4885
US-11091475-B2 Methods and compositions for modulating splicing RBM17, SF3B1, SNRPA1 TNF 4612/4885KDM4E 2530/4885ALDH1A1 4181/4885
US-20070179100-A1 Protected monomers PCNA, POLN, PARP1 TNF 2003/4885KDM4E 3196/4885ALDH1A1 1923/4885
US-20230059865-A1 METHODS AND COMPOSITIONS FOR MODULATING SPLICING RBM17, SF3B1, SNRPA1 TNF 4612/4885KDM4E 2530/4885ALDH1A1 4181/4885

“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.