SCHEMBL3344735

SCHEMBL3344735

Cc1c(Cc2ccc(Cl)cc2)c(=O)n(C)c2ccc(Cl)c(OCC(=O)O)c12

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.42
TRPC5 Q9UL62 1/20 0.39
KMT2A Q03164 3/20 0.39
THRA P10827 2/20 0.37
THRB P10828 2/20 0.37
RORC P51449 1/20 0.36
PPARD Q03181 1/20 0.36
TDP1 Q9NUW8 2/20 0.36
TSHR P16473 1/20 0.36
MCL1 Q07820 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 1/20 0.35
HIF1A Q16665 2/20 0.35
MEN1 O00255 2/20 0.34
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34

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
SCHEMBL3349038 0.90 PTGS2 (0.37) PPARGTRPC5KMT2AKDM4EALDH1A1
SCHEMBL3345407 0.83 PLA2G2A (0.45) PPARGKDM4EALDH1A1HPGD
SCHEMBL3345372 0.82 TDP1 (0.44) PPARGTRPC5THRATHRBRORC
SCHEMBL3345067 0.81 PPARG (0.42) PPARGTRPC5THRATHRBRORC
SCHEMBL3345066 0.80 TDP1 (0.43) PPARGTRPC5THRATHRBRORC
SCHEMBL3345051 0.77 P2RX3 (0.42) PPARGTRPC5RORCPPARDTDP1
SCHEMBL3346104 0.75 PLA2G10 (0.41) THRATHRBRORCTDP1TSHR
SCHEMBL3346068 0.74 TDP1 (0.43) PPARGTRPC5KMT2ATHRATHRB
SCHEMBL3345008 0.73 P2RX3 (0.43) TRPC5KMT2ARORCTDP1TSHR
SCHEMBL3348106 0.72 PTGDR2 (0.49) TRPC5KMT2ATSHRKDM4EALDH1A1

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
WO-2010040989-A1 QUINOLIN-2-ONE COMPOUNDS ARGENTA ORAL THERAPEUTICS LIMITED (GB) 2010-04-15 WO disclosed
WO-2010040989-A1 QUINOLIN-2-ONE COMPOUNDS ARGENTA ORAL THERAPEUTICS LIMITED (GB) 2010-04-15 WO disclosed