SCHEMBL13605139

SCHEMBL13605139

OC1(O)CCC(O)(c2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 16/20 0.61
OPRM1 P35372 11/20 0.61
OPRK1 P41145 11/20 0.61
OPRD1 P41143 9/20 0.50
POLB P06746 1/20 0.48
SIGMAR1 Q99720 1/20 0.44

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
SCHEMBL7815717 0.92 OPRL1 (0.68) OPRL1OPRM1OPRK1OPRD1POLB
SCHEMBL10060840 0.92 OPRL1 (0.68) OPRL1OPRM1OPRK1OPRD1POLB
SCHEMBL11762583 0.83 OPRL1 (0.59) OPRL1OPRM1OPRK1OPRD1POLB
SCHEMBL1724862 0.82 OPRL1 (0.57) OPRL1OPRM1OPRK1OPRD1POLB
SCHEMBL1109741 0.82 OPRL1 (0.57) OPRL1OPRM1OPRK1OPRD1POLB
SCHEMBL60129 0.80 OPRL1 (0.55) OPRL1OPRM1OPRK1OPRD1POLB
SCHEMBL1040024 0.80 OPRL1 (0.55) OPRL1OPRM1OPRK1OPRD1POLB
SCHEMBL29195226 0.80 OPRL1 (0.55) OPRL1OPRM1OPRK1OPRD1POLB
Ammonia Solution, Strong SCHEMBL29195223 0.80 OPRL1 (0.55) OPRL1OPRM1OPRK1OPRD1POLB
SCHEMBL16469256 0.80 OPRL1 (0.55) OPRL1OPRM1OPRK1OPRD1POLB

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
WO-2009150963-A1 PENTACYCLIC LIQUID CRYSTAL COMPOUND HAVING CYCLOHEXANE RING, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL DISPLAY ELEMENT チッソ株式会社 (JP) 2009-12-17 WO disclosed