SCHEMBL22277491

SCHEMBL22277491

C=CC1CCC(CCC2CCC(C3CCC(c4ccc(CCC)c(F)c4F)CC3)CC2)CC1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 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
SCHEMBL22277222 1.00 OPRL1 (0.30) OPRL1
SCHEMBL22277438 0.92
SCHEMBL22277659 0.91 OPRL1 (0.30) OPRL1
SCHEMBL22277351 0.91 OPRL1 (0.30) OPRL1
SCHEMBL22277429 0.91
SCHEMBL22277565 0.89
SCHEMBL22277500 0.88 CYP2C9 (0.35) OPRL1
SCHEMBL22277191 0.88 CYP2C9 (0.35) OPRL1
SCHEMBL22277638 0.88 HTR2A (0.32)
SCHEMBL739274 0.88 CYP2C9 (0.35) OPRL1

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
US-20200239775-A1 TETRACYCLIC LIQUID CRYSTAL COMPOUND HAVING DIATOMIC BONDING GROUP AND 2,3-DIFLUOROPHENYLENE, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY DEVICE JNC CORPORATION (JP) 2020-07-30 US disclosed