SCHEMBL8469010

SCHEMBL8469010

COc1ccccc1-c1c2c(cc3ccccc13)CNC2=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 2/20 0.45
RAB9A P51151 2/20 0.45
KMT2A Q03164 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
GPR84 Q9NQS5 1/20 0.44
NPSR1 Q6W5P4 2/20 0.43
STK10 O94804 2/20 0.43
SLK Q9H2G2 2/20 0.43
AURKA O14965 3/20 0.42
KDR P35968 3/20 0.42
C1R P00736 1/20 0.40
AHR P35869 1/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
GPR35 Q9HC97 1/20 0.39
THRB P10828 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL8468841 0.80 ALOX5 (0.53) MAPTALDH1A1RAB9ASMN1; SMN2GPR84
SCHEMBL28108979 0.75 MAPT (0.55) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL28662170 0.72 ALDH1A1 (0.52) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL13027936 0.70 AURKA (0.50) MAPTALDH1A1MEN1KMT2AAURKA
SCHEMBL26140521 0.69 GPR84 (0.49) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL31069613 0.68 AURKA (0.47) ALDH1A1AURKAKDRCA12CA9
SCHEMBL18858106 0.68 NQO1 (0.57) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL9834200 0.68 MAP3K9 (0.58) KDRPARP1
SCHEMBL21615640 0.67 GPR84 (0.57) MAPTALDH1A1MEN1RAB9AKMT2A
SCHEMBL11043607 0.67 MAPT (0.62) MAPTALDH1A1MEN1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0920416-A1 NAPHTHOLACTAMS AND LACTONES AS BONE MORPHOGENETIC PROTEIN ACTIVE AGENTS Takeda Chemical Industries, Ltd. (JP) 1999-06-09 EP disclosed
WO-1998007705-A1 NAPHTHOLACTAMS AND LACTONES AS BONE MORPHOGENETIC PROTEIN ACTIVE AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-02-26 WO disclosed