SCHEMBL9972161

SCHEMBL9972161

CC1(c2ccc(O)cc2)CCC(C(C)(C)CC2CCC(C(C)(C)c3ccc(O)cc3)CC2)CC1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.33
ESR2 Q92731 2/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 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
SCHEMBL2855402 0.87 ESR2 (0.38) ESR1ESR2
SCHEMBL2605554 0.74 ESR2 (0.48) ESR1ESR2OPRM1OPRD1OPRK1
SCHEMBL9972159 0.73 LMNA (0.44) ESR1ESR2
SCHEMBL14173076 0.71 THRB (0.38)
SCHEMBL14173077 0.70 KMT2A (0.40)
SCHEMBL2605551 0.70 ESR2 (0.43) ESR1ESR2OPRM1OPRD1OPRK1
SCHEMBL8006119 0.68 ELANE (0.46)
SCHEMBL9065614 0.68 ESR2 (0.44) ESR1ESR2OPRM1OPRD1OPRK1
SCHEMBL23977378 0.68 ESR2 (0.49) ESR1ESR2
SCHEMBL29577693 0.68 ESR1 (0.45) ESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8574745-B2 Resin composition and organic-electrolyte battery NISSAN MOTOR CO., LTD. (JP) 2013-11-05 US disclosed
US-20120156546-A1 RESIN COMPOSITION AND ORGANIC-ELECTROLYTE BATTERY NISSAN MOTOR CO., LTD. 2012-06-21 US disclosed