SCHEMBL9348750

SCHEMBL9348750

CC[C@H]1CC[C@@H](C2CCC(c3ccc(O)cc3)(c3ccc(O)cc3)CC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 15/20 0.48
ESR1 P03372 9/20 0.48
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL9348671 1.00 ESR2 (0.48) ESR2ESR1OPRD1OPRK1CYP3A4
SCHEMBL9348682 1.00 ESR2 (0.48) ESR2ESR1OPRD1OPRK1CYP3A4
SCHEMBL7183973 0.90 ESR2 (0.55) ESR2ESR1OPRD1OPRK1CYP3A4
SCHEMBL9352649 0.89 ESR2 (0.44) ESR2ESR1OPRD1OPRK1CYP2C9
SCHEMBL9352594 0.89 ESR2 (0.44) ESR2ESR1OPRD1OPRK1CYP2C9
SCHEMBL9352604 0.89 ESR2 (0.44) ESR2ESR1OPRD1OPRK1CYP2C9
SCHEMBL9353974 0.87 ESR2 (0.48) ESR2ESR1OPRD1OPRK1CYP3A4
SCHEMBL9353981 0.87 ESR2 (0.48) ESR2ESR1OPRD1OPRK1CYP3A4
SCHEMBL9348597 0.86 ESR2 (0.42) ESR2ESR1OPRD1OPRK1CYP3A4
SCHEMBL9348592 0.86 ESR2 (0.42) ESR2ESR1OPRD1OPRK1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0389092-B1 Liquid crystal-aligning coating and liquid crystal element CHISSO CORP (JP) 1994-09-07 EP disclosed
US-5152918-A Cyclohexyl aromatic polyimides; controlling pretilt angle CHISSO CORPORATION (JP) 1992-10-06 US disclosed
EP-0389092-A1 Liquid crystal-aligning coating and liquid crystal element CHISSO CORPORATION (JP) 1990-09-26 EP disclosed