SCHEMBL7913477

SCHEMBL7913477

CCc1cc(C2(c3cc(CC)c(O)c(C(C)C)c3)CC(C)CC(C)(C)C2)cc(C(C)C)c1O

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48

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
SCHEMBL7916026 0.90 ESR1 (0.46) ESR1ESR2
SCHEMBL7916024 0.89 ESR1 (0.47) ESR1ESR2
SCHEMBL7916059 0.88 ESR1 (0.56) ESR1ESR2
SCHEMBL299794 0.88 ESR1 (0.56) ESR1ESR2
SCHEMBL7916039 0.85 ESR1 (0.48) ESR1ESR2
SCHEMBL7064600 0.83 ESR1 (0.51) ESR1ESR2
SCHEMBL2779179 0.83 ESR1 (0.51) ESR1ESR2
SCHEMBL297898 0.82 ESR1 (0.50) ESR1ESR2
SCHEMBL298231 0.82 ESR1 (0.50) ESR1ESR2
SCHEMBL7916563 0.80 ESR1 (0.48) 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-6284931-B1 REACTION OF 3,3,5-TRIMETHYLCYCLOHEXANONE AND PHENOL TO FORM DIPHENOL DERIVATIVE HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2001-09-04 US disclosed
EP-0995737-A1 Process for producing 3,3,5-trimethylcyclohexylidenebisphenols Honshu Chemical Industry Co. Ltd. (JP) 2000-04-26 EP disclosed