SCHEMBL18697231

SCHEMBL18697231

C/C=C\c1ccc2c(c1C)OCC=C2

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.33
CYP1A2 P05177 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
SCHEMBL8404587 0.75 CYP1A2 (0.37) CYP1A1CYP1A2
SCHEMBL28439695 0.73 CYP1A1 (0.35) CYP1A1CYP1A2
SCHEMBL15676323 0.66 ERN1 (0.39) CYP1A1CYP1A2
SCHEMBL21969210 0.65 CYP1A1 (0.31) CYP1A1CYP1A2
SCHEMBL12043463 0.65 CYP2B6 (0.42) CYP1A1CYP1A2
SCHEMBL31028928 0.64 ESR1 (0.39)
SCHEMBL29519680 0.62 CYP2B6 (0.43) CYP1A1CYP1A2
SCHEMBL2557254 0.62 CYP2B6 (0.43) CYP1A1CYP1A2
SCHEMBL2458273 0.61 MAPT (0.47) CYP1A1CYP1A2
SCHEMBL31167435 0.61 CYP1A2 (0.38) CYP1A1CYP1A2

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
US-RE46357-E1 Photochromic film, photochromic lens comprising the same, and method of manufacturing photochromic lens HOYA CORPORATION (JP) 2017-04-04 US disclosed