SCHEMBL700577

SCHEMBL700577

C[C@H](NC(=O)c1nn(-c2ccccc2Cl)c(-c2ccc(Cl)cc2)c1Cc1nnn[nH]1)c1ccc(Br)cc1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 14/20 0.76
CNR2 P34972 3/20 0.63

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
SCHEMBL703804 1.00 CNR1 (0.76) CNR1CNR2
SCHEMBL709250 1.00 CNR1 (0.76) CNR1CNR2
SCHEMBL702556 0.96 CNR1 (0.69) CNR1CNR2
SCHEMBL701648 0.92 CNR1 (0.65) CNR1CNR2
SCHEMBL700626 0.91 CNR1 (0.63) CNR1CNR2
SCHEMBL702479 0.91 CNR1 (0.68) CNR1CNR2
SCHEMBL702914 0.90 CNR1 (0.70) CNR1CNR2
SCHEMBL702745 0.89 CNR1 (0.67) CNR1CNR2
SCHEMBL702755 0.89 CNR1 (0.68) CNR1CNR2
SCHEMBL702835 0.87 CNR1 (0.77) CNR1CNR2

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-8124634-B2 CB1 receptor modulators 7TM PHARMA A/S (DK) 2012-02-28 US disclosed