SCHEMBL9547848

SCHEMBL9547848

CCCCCCCCCCCCCCCCOC(C)c1ccc(-c2ccc(OCc3ccc(Cl)cc3)cc2)cc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.46
MAOB P27338 5/20 0.44
MAOA P21397 1/20 0.44
RARB P10826 3/20 0.43
APP P05067 1/20 0.43
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
NR4A2 P43354 1/20 0.42
DHFR P00374 1/20 0.41
NR5A1 Q13285 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 1/20 0.40
MAPK1 P28482 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
PPARG P37231 1/20 0.40
PPARA Q07869 1/20 0.40

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
SCHEMBL10333967 0.93 RARB (0.50) RARBRXRARXRBNR5A1
SCHEMBL9547770 0.88 PLA2G10 (0.49) FFAR1RARBMEN1KMT2A
SCHEMBL9547852 0.85 APP (0.48) FFAR1MAOBAPPRXRARXRB
SCHEMBL9547776 0.84 MEN1 (0.48) MAOBNR5A1MEN1KMT2A
SCHEMBL9330318 0.82 MAPT (0.47) RARBMEN1KMT2AMAPK1NPSR1
SCHEMBL9126010 0.79 NR5A1 (0.53) RARBRXRARXRBNR5A1MEN1
SCHEMBL14264671 0.77 RARB (0.61) RARBNR5A1
SCHEMBL9547745 0.77 ACACB (0.51) FFAR1
SCHEMBL9547831 0.76 NR5A1 (0.51) RARBNR5A1
SCHEMBL9547799 0.76 NR5A1 (0.51) RARBNR5A1

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
EP-0288297-B1 OPTICALLY ACTIVE BENZENE DERIVATIVES AND PROCESS FOR PREPARATION THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-03-17 EP disclosed
US-4985590-A Optically active benzene derivatives and process for preparation thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-01-15 US disclosed