SCHEMBL5320341

SCHEMBL5320341

OCC12CCCC(CCC1)CC2

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.31

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
SCHEMBL6160871 0.89 ESR1 (0.31) ESR2
SCHEMBL19388792 0.80
SCHEMBL226326 0.74
SCHEMBL23304761 0.72
SCHEMBL18912905 0.69 CYP1A2 (0.33)
SCHEMBL25238884 0.69
SCHEMBL18481467 0.68
SCHEMBL11799796 0.67
SCHEMBL31280122 0.67 GRIN2D (0.46)
SCHEMBL1100974 0.66

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
WO-2007092242-A1 PHOTOTHERMOGRAPHIC REDUCING AGENTS WITH BICYCLIC OR TRICYCLIC SUBSTITUTION CARESTREAM HEALTH, INC. (US) 2007-08-16 WO claimed
WO-2007092242-A1 PHOTOTHERMOGRAPHIC REDUCING AGENTS WITH BICYCLIC OR TRICYCLIC SUBSTITUTION CARESTREAM HEALTH, INC. (US) 2007-08-16 WO disclosed