SCHEMBL31746986

SCHEMBL31746986

CCCCCc1ccc(-c2ccc(-c3cc(O)c(CCO[Si](C)(C)C(C)(C)C)cc3O)cc2CC)cc1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RARB P10826 9/20 0.39
ALOX5 P09917 2/20 0.37
RARA P10276 2/20 0.34
RARG P13631 1/20 0.34
GPR84 Q9NQS5 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
GCGR P47871 1/20 0.34
EP300 Q09472 1/20 0.34
KAT5 Q92993 1/20 0.34
KAT8 Q9H7Z6 1/20 0.34
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
ABCB1 P08183 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
MTOR P42345 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL17070356 1.00 RARB (0.39) RARBALOX5RARARARGGPR84
SCHEMBL20067199 0.84 RARB (0.43) RARBRARARARGALDH1A1MEN1
SCHEMBL31746995 0.82 RARB (0.47) RARBALOX5RARARARGGPR84
SCHEMBL17070355 0.82 RARB (0.47) RARBALOX5RARARARGGPR84
SCHEMBL17070357 0.80 RARB (0.35) RARBALOX5RARARARGCNR2
SCHEMBL31746978 0.80 RARB (0.35) RARBALOX5RARARARGCNR2
SCHEMBL31746993 0.79 CNR2 (0.36) RARBRARARARGCNR1CNR2
SCHEMBL17070350 0.79 CNR2 (0.36) RARBRARARARGCNR1CNR2
SCHEMBL29733618 0.77 RARB (0.35) RARBRARARARGALDH1A1MEN1
SCHEMBL17063601 0.77 RARB (0.35) RARBRARARARGALDH1A1MEN1

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
EP-3730590-B1 LIQUID CRYSTAL MEDIA WITH HOMEOTROPIC ALIGNMENT MERCK PATENT GMBH (DE) 2025-12-24 EP disclosed