SCHEMBL8891479

SCHEMBL8891479

Cc1ccc(C(=O)O)cc1OCCc1ccccn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.51
MAPT P10636 1/20 0.51
SYK P43405 4/20 0.46
AURKB Q96GD4 1/20 0.46
INCENP Q9NQS7 1/20 0.46
POLB P06746 1/20 0.45
CASP6 P55212 1/20 0.45
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
RXRA P19793 1/20 0.43
RXRB P28702 1/20 0.43
RXRG P48443 1/20 0.43
PARP10 Q53GL7 1/20 0.42
MAPK14 Q16539 2/20 0.42
SMO Q99835 2/20 0.42
PPARG P37231 1/20 0.42
TSHR P16473 1/20 0.42
TTR P02766 2/20 0.41
ALB P02768 1/20 0.41

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
SCHEMBL8890306 0.88 L3MBTL1 (0.50) KDM4EMAPTPOLBMAPK14SMO
SCHEMBL17844308 0.86 KDM4E (0.61) KDM4EMAPTSYKAURKBINCENP
SCHEMBL8890013 0.86 KDM4E (0.61) KDM4EMAPTSYKAURKBINCENP
SCHEMBL8891783 0.81 RAB9A (0.50) KDM4EMAPTSYKAURKBINCENP
SCHEMBL15062003 0.79 SYK (0.46) KDM4EMAPTSYKSMN1; SMN2
SCHEMBL8892009 0.79 PDE4D (0.55) KDM4EMAPK14SMO
SCHEMBL1122621 0.78 PKM (0.63) POLBCYP1A2CYP2C19SMN1; SMN2PARP10
SCHEMBL3778535 0.77 KMT2A (0.58) KDM4EPOLBCYP1A2CYP2C19SMN1; SMN2
SCHEMBL12301168 0.77 CA12 (0.47) MAPTSYKCYP2C19SMN1; SMN2TSHR
SCHEMBL27990964 0.77 KDM4E (0.46) KDM4EMAPTSYKAURKBINCENP

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
WO-1997003967-A1 SUBSTITUTED AROMATIC COMPOUNDS AND THEIR PHARMACEUTICAL USE RHONE-POULENC RORER LIMITED (GB) 1997-02-06 WO disclosed