SCHEMBL4826752

SCHEMBL4826752

CCCc1ccc(-c2cccc(C(=O)O)c2C2CCC(CCC)CC2)cc1

nearest known ligand 0.43

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 5/20 0.43
BRS3 P32247 7/20 0.43
MCL1 Q07820 1/20 0.41
PPARG P37231 3/20 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
SCHEMBL9447323 1.00 LTB4R2 (0.43) LTB4R2BRS3MCL1PPARG
SCHEMBL4826396 0.92 LTB4R2 (0.42) LTB4R2BRS3MCL1PPARG
SCHEMBL9447196 0.92 LTB4R2 (0.42) LTB4R2BRS3MCL1PPARG
SCHEMBL4828276 0.87 LTB4R2 (0.41) LTB4R2PPARG
SCHEMBL4650931 0.84 LTB4R2 (0.43) LTB4R2BRS3PPARG
SCHEMBL9763900 0.81 NFE2L2 (0.41) LTB4R2
SCHEMBL9763895 0.81 NFE2L2 (0.41) LTB4R2
SCHEMBL4826565 0.81 NFE2L2 (0.42) LTB4R2
SCHEMBL11046109 0.80 CYP2C9 (0.46) LTB4R2BRS3MCL1
SCHEMBL10946281 0.79 MCL1 (0.46) LTB4R2BRS3MCL1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060249708-A1 Nematic liquid crystal mixtures for use in bistable display devices CDC PROPRIETE INTELLECTUELLE (FR) 2006-11-09 US claimed
US-7335405-B2 Nematic liquid crystal mixtures for use in bistable display devices NEMOPTIC (FR) 2008-02-26 US disclosed
US-20060249708-A1 Nematic liquid crystal mixtures for use in bistable display devices CDC PROPRIETE INTELLECTUELLE (FR) 2006-11-09 US disclosed
US-5211878-A Difluorobenzonitrile derivatives MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1993-05-18 US disclosed