SCHEMBL14366361

SCHEMBL14366361

Bc1ccc(C)c(C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.43
HAAO P46952 1/20 0.42
ALDH1A1 P00352 3/20 0.42
KDM4E B2RXH2 4/20 0.41
HPGD P15428 2/20 0.41
HSD17B10 Q99714 2/20 0.41
CSNK2A1 P68400 1/20 0.41
NOTUM Q6P988 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 2/20 0.39
NR1H4 Q96RI1 1/20 0.39
CASR P41180 1/20 0.39
TSHR P16473 1/20 0.39
POLB P06746 1/20 0.39
CYP1A2 P05177 1/20 0.39
HMGB1 P09429 1/20 0.37
CXCL12 P48061 1/20 0.37
MYC P01106 1/20 0.37
GABRP O00591 1/20 0.37

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
SCHEMBL257346 0.84 RXRB (0.49) MCL1HAAOALDH1A1KDM4EHPGD
SCHEMBL14366362 0.81 TDP1 (0.46) ALDH1A1MEN1KMT2APOLB
SCHEMBL13652578 0.79 ALDH1A1 (0.48) HAAOALDH1A1KDM4EHSD17B10MEN1
SCHEMBL23662320 0.78 CA12 (0.47) ALDH1A1KDM4EHPGDHSD17B10GAA
SCHEMBL14683982 0.78 POLB (0.40) KDM4EHPGDHSD17B10GAAPOLB
SCHEMBL223101 0.77 CSNK2A1 (0.65) MCL1ALDH1A1KDM4EHPGDCSNK2A1
SCHEMBL70164 0.77 MCL1 (0.66) MCL1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL1334366 0.76 CA12 (0.61) MCL1ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL6917333 0.76 CSNK2A1 (0.63) MCL1ALDH1A1KDM4EHPGDCSNK2A1
SCHEMBL6916095 0.76 CSNK2A1 (0.63) MCL1ALDH1A1KDM4ECSNK2A1NOTUM

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-2007146838-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-21 WO disclosed