SCHEMBL28019408

SCHEMBL28019408

Cc1ccccc1-c1ncccc1-c1ccc2c(=O)nc[nH]c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 1/20 0.39
▸ ACVR1 Q04771 2/20 0.39
▸ TNKS2 Q9H2K2 3/20 0.38
▸ TNKS O95271 1/20 0.38
▸ QPCT Q16769 1/20 0.38
▸ QPCTL Q9NXS2 1/20 0.38
▸ PRMT5 O14744 2/20 0.37
▸ WDR77 Q9BQA1 2/20 0.37
▸ CTSL P07711 1/20 0.36
▸ PTPRC P08575 1/20 0.36
▸ CTSS P25774 1/20 0.36
▸ PTPN13 Q12923 1/20 0.36
▸ TGFBR1 P36897 3/20 0.36
▸ TDO2 P48775 1/20 0.36
▸ KMO O15229 1/20 0.35
▸ TRPA1 O75762 1/20 0.35
▸ CCNB2 O95067 1/20 0.35
▸ CDK1 P06493 1/20 0.35
▸ CCNB1 P14635 1/20 0.35
▸ CCNA2 P20248 1/20 0.35

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
SCHEMBL28019404 0.91 ACVR1 (0.41) ACVR1QPCTQPCTLPRMT5WDR77
SCHEMBL28019407 0.87 ACVR1 (0.39) TRPV1ACVR1TNKS2QPCTQPCTL
SCHEMBL15638787 0.84 KMO (0.46) TRPV1ACVR1TNKS2TNKSPRMT5
SCHEMBL15640109 0.84 MAPK14 (0.43) TRPV1ACVR1TGFBR1KMOPTGS1
SCHEMBL28019403 0.77 ACVR1 (0.42) ACVR1PRMT5WDR77TGFBR1KMO
SCHEMBL15640075 0.76 ACVR1 (0.37) ACVR1QPCTQPCTLTGFBR1KMO
SCHEMBL15639315 0.75 KMO (0.46) TRPV1ACVR1TNKS2TNKSPRMT5
SCHEMBL15637987 0.74 MAPK14 (0.43) ACVR1TGFBR1KMOPTGS1PTGS2
SCHEMBL15984811 0.71 TGFBR1 (0.39) ACVR1TNKS2QPCTQPCTLTGFBR1
SCHEMBL28019364 0.70 TGFBR1 (0.63) TGFBR1PTGS1PTGS2ALOX5APFEN1

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-104837832-A GDF-8 inhibitors RIGEL PHARMACEUTICALS INC 2015-08-12 — — CN disclosed
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