SCHEMBL4895197

SCHEMBL4895197

Cc1ccc(-c2cccc3cc4ccccc4c(-c4ccc(C)cc4)c23)cc1.c1ccc(-c2c3ccccc3c(-c3ccccc3)c3ccccc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 3/20 0.48
CES1 P23141 1/20 0.48
ENPP1 P22413 1/20 0.40
ALOX5 P09917 2/20 0.40
ACHE P22303 2/20 0.39
NQO2 P16083 1/20 0.38
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 3/20 0.37
HPGD P15428 3/20 0.37
MAPT P10636 2/20 0.37
MPI P34949 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ANPEP P15144 1/20 0.36
POLB P06746 1/20 0.36
PPARG P37231 1/20 0.36
MCL1 Q07820 1/20 0.36
NR2E3 Q9Y5X4 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
SCHEMBL2519749 0.88 CES1 (0.59) GPR84CES1ENPP1ALOX5ACHE
SCHEMBL4845570 0.86 CES1 (0.61) GPR84CES1ALOX5ACHENQO2
SCHEMBL25125399 0.82 GPR84 (0.50) GPR84CES1ENPP1ALOX5ACHE
SCHEMBL25125398 0.82 GPR84 (0.50) GPR84CES1ENPP1ALOX5ACHE
SCHEMBL21358003 0.82 CES1 (0.56) GPR84CES1ALOX5ACHENQO2
SCHEMBL28495403 0.81 ENPP1 (0.44) GPR84ENPP1ACHEKDM4EALDH1A1
SCHEMBL1505828 0.81 ALOX5 (0.55) GPR84ALOX5ACHENQO2MEN1
SCHEMBL29034309 0.81 CES1 (0.51) GPR84CES1ALOX5ACHENQO2
SCHEMBL21838774 0.80 CES1 (0.54) GPR84CES1ALOX5ACHENQO2
SCHEMBL31240158 0.80 CES1 (0.54) GPR84CES1ALOX5ACHENQO2

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
US-20080044149-A1 Polymerizable Composition TOYO INK MFG. CO., LTD. (JP) 2008-02-21 US disclosed