SCHEMBL9982124

SCHEMBL9982124

O=C1CCc2cc3ccc(Cl)cc3cc2C12CC1=CCC2C1

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 1/20 0.30

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
SCHEMBL9981612 1.00 CYP2A6 (0.30) CYP2A6
SCHEMBL9981639 0.89 KDM1A (0.35)
SCHEMBL9981506 0.88 SRD5A1 (0.35)
SCHEMBL1739240 0.87 GRM1 (0.31)
SCHEMBL9981588 0.86 ALDH1A1 (0.34) CYP2A6
SCHEMBL9981133 0.86 CA9 (0.33)
SCHEMBL9981900 0.86 ALDH1A1 (0.34) CYP2A6
SCHEMBL9981988 0.86 CA9 (0.33)
SCHEMBL9982460 0.84 ESR1 (0.33)
SCHEMBL1740579 0.84 HPGD (0.35)

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-8211514-B2 Reverse dispersion retardation film and liquid crystal display device using the same JX NIPPON OIL & ENERGY CORPORATION (JP) 2012-07-03 US disclosed