SCHEMBL3423488

SCHEMBL3423488

O=c1[nH]c2c(Cl)ccc(C(F)(F)F)c2cc1O

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DAO P14920 10/20 0.49
KMT2A Q03164 3/20 0.39
DDO Q99489 5/20 0.39
CSNK2A2 P19784 1/20 0.38
CSNK2B P67870 1/20 0.38
CSNK2A1 P68400 1/20 0.38
MAPT P10636 1/20 0.36
MEN1 O00255 2/20 0.36
LMNA P02545 1/20 0.36
MCL1 Q07820 1/20 0.36
KDR P35968 1/20 0.36
COMT P21964 1/20 0.35
BRAF P15056 1/20 0.35
HTT P42858 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
SCHEMBL3360150 0.81 DAO (0.59) DAOKMT2ADDOMEN1HTT
SCHEMBL3419432 0.78 DAO (0.51) DAOKMT2ADDOMEN1LMNA
SCHEMBL29951361 0.74 PIM1 (0.36) KMT2AMAPTMEN1LMNAKDR
SCHEMBL3360159 0.73 DAO (0.58) DAODDO
SCHEMBL3359175 0.72 DAO (0.64) DAOKMT2ADDOMAPTMEN1
SCHEMBL3434396 0.71 DAO (0.47) DAOKMT2ADDO
SCHEMBL3361211 0.70 DAO (0.53) DAODDOMAPT
SCHEMBL9389416 0.70 DAO (0.66) DAODDO
SCHEMBL29985445 0.69 CDK1 (0.55) KMT2AMAPTMEN1LMNAHTT
SCHEMBL3418623 0.69 DAO (0.64) DAOKMT2ADDOMEN1LMNA

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-2010058314-A1 HYDROXYQUINOLIN-2(1H)-ONES AND DERIVATIVES THEREOF PFIZER INC. (US) 2010-05-27 WO disclosed