SCHEMBL14201250

SCHEMBL14201250

CCCCCOc1c(OC)ccc2cc(C(=O)NCc3ccc(C)cc3)c(=O)[nH]c12

nearest known ligand 0.85

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 20/20 0.85
CNR1 P21554 4/20 0.75
ALDH1A1 P00352 1/20 0.75

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
SCHEMBL3664503 0.87 CNR2 (0.86) CNR2CNR1ALDH1A1
SCHEMBL1165264 0.87 CNR2 (0.86) CNR2CNR1ALDH1A1
SCHEMBL12862694 0.87 CNR2 (0.86) CNR2CNR1ALDH1A1
SCHEMBL3656878 0.87 CNR2 (0.86) CNR2CNR1ALDH1A1
SCHEMBL30187039 0.86 CNR2 (1.00) CNR2CNR1ALDH1A1
SCHEMBL3684662 0.86 CNR2 (1.00) CNR2CNR1ALDH1A1
SCHEMBL4410778 0.82 CNR2 (0.76) CNR2CNR1
SCHEMBL4910778 0.81 CNR2 (0.77) CNR2CNR1ALDH1A1
SCHEMBL2774135 0.81 CNR2 (0.93) CNR2CNR1
SCHEMBL5903605 0.80 CNR2 (0.76) CNR2CNR1

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-7358245-B2 Treatment of gastroesophageal reflux disease ASTRAZENCA AB (SE) 2008-04-15 US disclosed