SCHEMBL28202384

SCHEMBL28202384

O=CNc1ccc(Br)c2c1[nH]c1cc(CO)ccc12

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ PARP1 P09874 1/20 0.36
▸ CDK4 P11802 1/20 0.36
▸ CCND1 P24385 1/20 0.36
▸ CDK1 P06493 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ AR P10275 1/20 0.32
▸ PIM1 P11309 1/20 0.30
▸ PIM3 Q86V86 1/20 0.30
▸ PIM2 Q9P1W9 1/20 0.30
▸ SRC P12931 1/20 0.30
▸ PRKACA P17612 1/20 0.30
▸ PRKACG P22612 1/20 0.30
▸ PRKACB P22694 1/20 0.30

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
SCHEMBL28203028 0.78 CDK4 (0.48) MAOADYRK1ACDK4CCND1CDK1
SCHEMBL28851455 0.76 BTK (0.39) MAOADYRK1ACDK4CCND1CDK2
SCHEMBL149527 0.75 BTK (0.47) MAOADYRK1APARP1CDK4CCND1
SCHEMBL3690163 0.69 KIF11 (0.41) MAOADYRK1APARP1CDK4CCND1
SCHEMBL28177392 0.65 ALDH1A1 (0.38) DYRK1ACDK4CCND1CDK1CDK2
SCHEMBL28166025 0.64 CDK4 (0.47) CDK4CCND1CDK2
SCHEMBL20684923 0.64 KDM5A (0.37) —
SCHEMBL149450 0.63 BTK (0.49) DYRK1ACDK2
SCHEMBL148529 0.62 BTK (0.42) CDK2
SCHEMBL16334012 0.62 BTK (0.47) MAOADYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105473573-B Carbazole carboxamide compounds useful as kinase inhibitor 百时美施贵宝公司 2018-03-16 — — CN disclosed
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