SCHEMBL28164948

SCHEMBL28164948

Cc1c(C)n(Cl)c2c(C(N)=O)cccc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FABP4 P15090 1/20 0.48
▸ KDM4E B2RXH2 6/20 0.39
▸ PARP1 P09874 6/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ ATM Q13315 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.38
▸ GAA P10253 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ MAPT P10636 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ CD38 P28907 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ MYC P01106 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ SMN1; SMN2 Q16637 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
SCHEMBL28165039 0.87 FABP4 (0.62) FABP4KDM4EKMT2AALDH1A1MAPT
SCHEMBL28164552 0.82 FABP4 (0.43) FABP4KDM4EPARP1KMT2AATM
SCHEMBL28164438 0.82 FABP4 (0.43) FABP4KDM4EPARP1KMT2AATM
Hydrochloric Acid SCHEMBL28263901 0.82 FABP4 (0.43) FABP4KDM4EPARP1KMT2AATM
SCHEMBL19924466 0.82 FABP4 (0.43) FABP4KDM4EPARP1KMT2AATM
SCHEMBL29782416 0.74 FABP4 (0.38) FABP4KDM4EPARP1ATMALDH1A1
SCHEMBL29782685 0.72 FABP4 (0.36) FABP4KDM4EPARP1KMT2AALDH1A1
SCHEMBL39964 0.71 KDM4E (0.52) KDM4EPARP1ALDH1A1GAAMAPT
Hydrochloric Acid SCHEMBL4562961 0.69 PARP1 (0.50) KDM4EPARP1ALDH1A1GAAMAPT
SCHEMBL28837954 0.69 FABP4 (0.41) FABP4PARP1KMT2AATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110511209-A It can be used as the indole carboxamides compound of kinase inhibitor BRISTOL MYERS SQUIBB CO 2019-11-29 — — CN claimed
CN-107108583-A Indole carboxamide compounds useful as kinase inhibitors 百时美施贵宝公司 2017-08-29 — — CN claimed
CN-110511209-A It can be used as the indole carboxamides compound of kinase inhibitor BRISTOL MYERS SQUIBB CO 2019-11-29 — — CN disclosed
CN-107108583-A Indole carboxamide compounds useful as kinase inhibitors 百时美施贵宝公司 2017-08-29 — — CN disclosed
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