SCHEMBL6480135

SCHEMBL6480135

Cc1noc(-c2c(F)cccc2-c2ccc(C(C)NC(=O)O)c(F)c2)n1

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 18/20 0.70
NPY2R P49146 1/20 0.39
HCRTR1 O43613 1/20 0.38
HCRTR2 O43614 1/20 0.38

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
SCHEMBL6183369 1.00 BDKRB1 (0.70) BDKRB1NPY2RHCRTR1HCRTR2
Hydrochloric Acid SCHEMBL6187618 0.86 BDKRB1 (0.73) BDKRB1
SCHEMBL6181950 0.83 BDKRB1 (1.00) BDKRB1
Hydrochloric Acid SCHEMBL6184751 0.82 BDKRB1 (0.55) BDKRB1HCRTR1HCRTR2
SCHEMBL6185032 0.81 BDKRB1 (0.80) BDKRB1
SCHEMBL3534819 0.75 BDKRB1 (0.55) BDKRB1
SCHEMBL20437900 0.70 ACHE (0.49) BDKRB1NPY2R
SCHEMBL1586134 0.70 HCRTR1 (0.55) HCRTR1HCRTR2
SCHEMBL1586661 0.68 HCRTR1 (0.54) HCRTR1HCRTR2
SCHEMBL17071971 0.68 HCRTR1 (0.54) BDKRB1HCRTR1HCRTR2

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-6919343-B2 N-biphenyl(substituted methyl) aminocycloalkane-carboxamide derivatives MERCK & CO., INC. (US) 2005-07-19 US disclosed