SCHEMBL5772704

SCHEMBL5772704

Cc1nc(Cl)c2[nH]c(-c3ccc(Cl)cc3)cc2n1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 19/20 0.56
CCNB2 O95067 1/20 0.50
CDK1 P06493 1/20 0.50
CCNB1 P14635 1/20 0.50
CCNB3 Q8WWL7 1/20 0.50

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
SCHEMBL5773530 0.91 NPY5R (0.58) NPY5RCCNB2CDK1CCNB1CCNB3
SCHEMBL5772401 0.89 NPY5R (0.70) NPY5R
SCHEMBL5772070 0.88 NPY5R (0.60) NPY5RCCNB2CDK1CCNB1CCNB3
SCHEMBL5772872 0.85 NPY5R (0.68) NPY5R
SCHEMBL5773787 0.85 NPY5R (0.61) NPY5RCCNB2CDK1CCNB1CCNB3
SCHEMBL5772568 0.85 NPY5R (0.50) NPY5R
SCHEMBL5773389 0.85 NPY5R (0.50) NPY5RCCNB2CDK1CCNB1CCNB3
SCHEMBL5773369 0.84 NPY5R (0.56) NPY5R
SCHEMBL5776833 0.81 NPY5R (0.47) NPY5R
SCHEMBL5775599 0.78 NPY5R (0.72) NPY5R

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-1054887-B1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC (US) 2006-04-12 EP disclosed
US-6583154-B1 Neuropeptide Y antagonist; pyrrolo-(3,2-b)pyridines and pyrrolo-(3,2-d)pyrimidines AMGEN INC. 2003-06-24 US disclosed
US-6187777-B1 PYRROLO(3,2-D)PYRIMIDINE DERIVATIVES; NEUROPEPTIDE Y AND CORTICOTROPIN RELEASING FACTOR MODULATORS; DIETETICS; ANTIDIABETIC, ANTIINFLAMMATORY, AND ANTITUMOR AGENTS AMGEN INC. 2001-02-13 US disclosed