SCHEMBL3981440

SCHEMBL3981440

CCc1cc2c(Cl)ccc(O)c2nc1Cc1ccc(Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
ALOX15 P16050 1/20 0.38
HIF1A Q16665 1/20 0.38
HSD17B10 Q99714 1/20 0.38
CCNE2 O96020 3/20 0.36
CCNE1 P24864 3/20 0.36
CDK2 P24941 3/20 0.36
CCNB2 O95067 2/20 0.36
CDK1 P06493 2/20 0.36
CDK4 P11802 2/20 0.36
CCNB1 P14635 2/20 0.36
CCND1 P24385 2/20 0.36
CCNB3 Q8WWL7 2/20 0.36
ERCC1 P07992 2/20 0.36
ERCC4 Q92889 2/20 0.36
FABP4 P15090 1/20 0.36

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
SCHEMBL3984323 0.82 LMNA (0.43) MEN1KMT2AMAPTCYP3A4HPGD
SCHEMBL3985312 0.79 TDP1 (0.47) MAPTHPGDHSD17B10
SCHEMBL3989567 0.78 LMNA (0.41) KMT2AMAPTHPGDHIF1APARP1
SCHEMBL3984015 0.78 ERCC1 (0.37) MEN1KMT2AMAPTCYP3A4HPGD
SCHEMBL3989921 0.73 LMNA (0.41) MEN1KMT2AMAPTCYP3A4HPGD
SCHEMBL3771921 0.68 CCNE2 (0.39) KMT2ACCNE2CCNE1CDK2CCNB2
SCHEMBL31301800 0.66 KDM4E (0.47) MAPTALOX15PARP1
SCHEMBL4187887 0.66 SELPLG (0.48) CYP3A4FABP4LDHALDHB
SCHEMBL3984739 0.65 LMNA (0.38) MEN1KMT2AMAPTCYP3A4HPGD
SCHEMBL10826427 0.64 CYP3A4 (0.47) MEN1KMT2AMAPTCYP3A4HPGD

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-2009060209-A1 6,6-FUSED BICYCLIC AROMATIC COMPOUNDS AND THEIR THERAPEUTI USE ARGENTA DISCOVERY LIMITED (GB) 2009-05-14 WO disclosed