SCHEMBL5133331

SCHEMBL5133331

Cc1cc(C=O)c(N(CC2CC2)CC2CC2)nc1C(C)C

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 18/20 0.35

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
SCHEMBL5623905 0.83 CRHR1 (0.36) CRHR1
SCHEMBL5042709 0.74 PARP14 (0.38) CRHR1
SCHEMBL2395175 0.73 CRHR1 (0.36) CRHR1
SCHEMBL5049417 0.71 CRHR1 (0.36) CRHR1
SCHEMBL5626979 0.70 PDE10A (0.34) CRHR1
SCHEMBL14698256 0.68 RXRA (0.35) CRHR1
SCHEMBL5132600 0.68 CRHR1 (0.32) CRHR1
SCHEMBL14833512 0.68 CRHR1 (0.32) CRHR1
SCHEMBL5046447 0.67 GRM2 (0.37) CRHR1
SCHEMBL5133328 0.67 CRHR1 (0.32) CRHR1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981342-B1 SELECTIVE BENZYLAMINE DERIVATIVES AND THEIR UTILITY AS CHOLESTEROL ESTER-TRANSFER PROTEIN INHIBITORS REDDYS LAB LTD DR (IN) 2016-11-30 EP disclosed
EP-1981342-A1 SELECTIVE BENZYLAMINE DERIVATIVES AND THEIR UTILITY AS CHOLESTEROL ESTER-TRANSFER PROTEIN INHIBITORS Reddy US Therapeutics, Inc. (US) 2008-10-22 EP disclosed
WO-2007075194-A1 SELECTIVE BENZYLAMINE DERIVATIVES AND THEIR UTILITY AS CHOLESTEROL ESTER-TRANSFER PROTEIN INHIBITORS REDDY US THERAPEUTICS, INC. (US) 2007-07-05 WO disclosed