SCHEMBL8015649

SCHEMBL8015649

CC[C@H]1CC[C@H](C2CCC(c3cc(F)c(F)c(F)c3)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPV3 Q8NET8 1/20 0.32
OPRM1 P35372 1/20 0.30
OPRK1 P41145 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL18512507 1.00 TRPV3 (0.32) TRPV3OPRM1OPRK1ALDH1A1
SCHEMBL8015656 1.00 TRPV3 (0.32) TRPV3OPRM1OPRK1ALDH1A1
SCHEMBL3437354 1.00 TRPV3 (0.32) TRPV3OPRM1OPRK1ALDH1A1
SCHEMBL8736434 1.00 TRPV3 (0.32) TRPV3OPRM1OPRK1ALDH1A1
SCHEMBL18512508 0.95 CYP2C9 (0.33) TRPV3ALDH1A1
SCHEMBL9763946 0.95 TRPV3 (0.34) TRPV3ALDH1A1
SCHEMBL8860603 0.95 TRPV3 (0.34) TRPV3ALDH1A1
SCHEMBL16488482 0.91 ALDH1A1 (0.32) ALDH1A1
SCHEMBL9177439 0.90 SLC6A2 (0.31)
SCHEMBL8736323 0.90 CYP2C9 (0.36) TRPV3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0704512-B1 A liquid crystal composition and a liquid crystal display element using the same CHISSO CORP (JP) 2000-03-08 EP disclosed
EP-0679707-B1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORP (JP) 1999-06-16 EP disclosed
EP-0833876-A1 NEMATIC LIQUID-CRYSTAL COMPOSITION MERCK PATENT GmbH (DE) 1998-04-08 EP disclosed
US-5720899-A Liquid crystalline compound, liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1998-02-24 US disclosed
US-5653911-A Liquid crystalline compound liquid crystal composition and liquid crystal display element CHISSO CORPORATION (JP) 1997-08-05 US disclosed
EP-0597701-B1 Conjugated enyne derivative and liquid crystal composition CHISSO CORP (JP) 1997-04-16 EP disclosed
WO-1997000924-A1 NEMATIC LIQUID-CRYSTAL COMPOSITION MERCK PATENT GMBH (DE) 1997-01-09 WO disclosed
EP-0704512-A1 A liquid crystal composition and a liquid crystal display element using the same Chisso Corporation (JP) 1996-04-03 EP disclosed
EP-0679707-A1 Liquid crystalline compound, liquid crystal composition and liquid crystal display element Chisso Corporation (JP) 1995-11-02 EP disclosed
EP-0597701-A1 Conjugated enyne derivative and liquid crystal composition CHISSO CORPORATION (JP) 1994-05-18 EP disclosed
US-5032313-A Trifluorobenzene derivative and liquid crystal composition containing the same CHISSO CORPORATION (JP) 1991-07-16 US disclosed
EP-0387032-A1 Trifluorobenzene derivatives and liquid crystal compositions containing the same Chisso Corporation (JP) 1990-09-12 EP disclosed