SCHEMBL26698382

SCHEMBL26698382

CCCC1CCC(C2CCC(O)(c3ccc(F)c(C(F)(F)F)c3F)CC2)CC1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.38
OPRK1 P41145 1/20 0.38
OPRL1 P41146 1/20 0.38
TLR4 O00206 1/20 0.31
KCNN4 O15554 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
SCHEMBL14494616 0.88 OPRL1 (0.36) OPRM1OPRK1OPRL1TLR4
SCHEMBL2909182 0.88 OPRL1 (0.36) OPRM1OPRK1OPRL1TLR4
SCHEMBL2909177 0.88 OPRL1 (0.36) OPRM1OPRK1OPRL1TLR4
SCHEMBL2909179 0.88 OPRL1 (0.36) OPRM1OPRK1OPRL1TLR4
SCHEMBL22877094 0.85 TAS1R3 (0.33)
SCHEMBL20808301 0.84 OPRL1 (0.39) OPRM1OPRK1OPRL1TLR4KCNN4
SCHEMBL20808304 0.84 OPRL1 (0.39) OPRM1OPRK1OPRL1TLR4KCNN4
SCHEMBL20797012 0.84 OPRL1 (0.39) OPRM1OPRK1OPRL1TLR4KCNN4
SCHEMBL6404087 0.81 OPRM1 (0.37) OPRM1OPRK1OPRL1TLR4
SCHEMBL17916601 0.81 OPRM1 (0.35) OPRM1OPRK1OPRL1TLR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119120038-A Liquid crystal medium, liquid crystal display device containing same and compound 默克专利股份有限公司 2024-12-13 CN disclosed
CN-114144498-B Liquid crystal medium, liquid crystal display device containing same and compound 默克专利股份有限公司 2024-09-10 CN disclosed
US-11795398-B2 Liquid-crystalline medium and liquid-crystal display comprising the same and compounds MERCK PATENT GMBH (DE) 2023-10-24 US disclosed
US-11795398-B2 Liquid-crystalline medium and liquid-crystal display comprising the same and compounds MERCK PATENT GMBH (DE) 2023-10-24 US disclosed
EP-3994234-A1 LIQUID-CRYSTALLINE MEDIUM AND LIQUID-CRYSTAL DISPLAY COMPRISING THE SAME AND COMPOUNDS Merck Patent GmbH (DE) 2022-05-11 EP disclosed
CN-114144498-A Liquid crystal medium, liquid crystal display containing same and compound 默克专利股份有限公司 2022-03-04 CN disclosed