SCHEMBL18285259

SCHEMBL18285259

C=CC(=O)NCc1ccc(Br)cn1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 2/20 0.59
F13A1 P00488 1/20 0.44
LMNA P02545 1/20 0.44
TGM1 P22735 1/20 0.44
TGM3 Q08188 1/20 0.44
NPC1 O15118 2/20 0.43
FPR2 P25090 1/20 0.42
CDK13 Q14004 3/20 0.42
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 2/20 0.40
CDK7 P50613 1/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 2/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
RAB9A P51151 2/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL2099046 0.80 KDM4E (0.47) LMNANPC1FPR2CYP2C19KMT2A
SCHEMBL15819917 0.79 NPSR1 (0.51) NPC1FPR2KMT2AALDH1A1KDM4E
SCHEMBL19739532 0.76 FPR2 (0.43) NPC1FPR2KMT2AALDH1A1KDM4E
SCHEMBL29806233 0.76 FPR2 (0.43) NPC1FPR2KMT2AALDH1A1KDM4E
SCHEMBL12874091 0.75 FPR2 (0.42) NPC1FPR2KMT2AALDH1A1KDM4E
SCHEMBL12492927 0.75 FPR2 (0.42) LMNANPC1FPR2KMT2AALDH1A1
SCHEMBL8966436 0.75 TGM2 (1.00) TGM2F13A1LMNATGM1TGM3
SCHEMBL30448897 0.74 ALDH1A1 (0.68) LMNANPC1KMT2AALDH1A1KDM4E
SCHEMBL10193856 0.74 ALDH1A1 (0.68) LMNANPC1KMT2AALDH1A1KDM4E
SCHEMBL17338750 0.74 FPR2 (0.52) LMNANPC1FPR2KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12331023-B2 Substituted heterocyclyl derivatives as CDK inhibitors AURIGENE ONCOLOGY LIMITED (IN) 2025-06-17 US disclosed
EP-3302448-B1 SUBSTITUTED HETEROCYCLYL DERIVATIVES AS CDK INHIBITORS AURIGENE ONCOLOGY LTD (IN) 2023-10-25 EP disclosed
EP-3302448-B1 SUBSTITUTED HETEROCYCLYL DERIVATIVES AS CDK INHIBITORS AURIGENE ONCOLOGY LTD (IN) 2023-10-25 EP disclosed
US-20230250062-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE ONCOLOGY LIMITED (IN) 2023-08-10 US disclosed
US-20230250062-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE ONCOLOGY LIMITED (IN) 2023-08-10 US disclosed
US-20220098156-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2022-03-31 US disclosed
CN-113773257-A Substituted heterocyclic derivatives as CDK inhibitors 奥瑞基尼探索技术有限公司 2021-12-10 CN disclosed
US-11174232-B2 Substituted heterocyclyl derivatives as CDK inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2021-11-16 US disclosed
US-11174232-B2 Substituted heterocyclyl derivatives as CDK inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2021-11-16 US disclosed
CN-108024970-B Substituted heterocyclic derivatives as CDK inhibitors 奥瑞基尼探索技术有限公司 2021-10-01 CN disclosed
US-20200262793-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2020-08-20 US disclosed
US-20200262793-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2020-08-20 US disclosed
US-10689347-B2 Substituted heterocyclyl derivatives as CDK inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2020-06-23 US disclosed
US-10689347-B2 Substituted heterocyclyl derivatives as CDK inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2020-06-23 US disclosed
US-20180362471-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-12-20 US disclosed
US-20180155293-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-06-07 US disclosed
US-20180155293-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2018-06-07 US disclosed
EP-3302448-A1 SUBSTITUTED HETEROCYCLYL DERIVATIVES AS CDK INHIBITORS Aurigene Discovery Technologies Limited (IN) 2018-04-11 EP disclosed
WO-2016193939-A1 SUBSTITUTED HETEROCYCLYL DERIVATIVES AS CDK INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-12-08 WO disclosed
WO-2016193939-A1 SUBSTITUTED HETEROCYCLYL DERIVATIVES AS CDK INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-12-08 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 (8 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-20230250062-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK9, CDK1 TGM2 3352/4885F13A1 2592/4885LMNA 1304/4885
US-11174232-B2 Substituted heterocyclyl derivatives as CDK inhibitors CDK19, CDK9, CDK1 TGM2 3352/4885F13A1 2592/4885LMNA 1304/4885
US-20180362471-A9 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK17, CDK1 TGM2 3139/4885F13A1 2314/4885LMNA 1389/4885
US-20180155293-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK17, CDK1 TGM2 3139/4885F13A1 2314/4885LMNA 1389/4885
US-10689347-B2 Substituted heterocyclyl derivatives as CDK inhibitors CDK19, CDK9, CDK1 TGM2 3352/4885F13A1 2592/4885LMNA 1304/4885
US-12331023-B2 Substituted heterocyclyl derivatives as CDK inhibitors CDK19, CDK9, CDK1 TGM2 3352/4885F13A1 2592/4885LMNA 1304/4885
US-20200262793-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK9, CDK1 TGM2 3352/4885F13A1 2592/4885LMNA 1304/4885
US-20220098156-A1 Substituted Heterocyclyl Derivatives as CDK Inhibitors CDK19, CDK9, CDK1 TGM2 3352/4885F13A1 2592/4885LMNA 1304/4885

“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.