SCHEMBL5774307

SCHEMBL5774307

Cc1nc(Cl)c(N)c(N2CCCCC2)n1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 1/20 0.45
PDE10A Q9Y233 2/20 0.44
NPY5R Q15761 10/20 0.43
GFER P55789 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HTT P42858 1/20 0.41
CTSK P43235 1/20 0.41
MAPK1 P28482 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL27741341 0.79 HSD17B10 (0.44) MEN1KMT2ANPY5RSMN1; SMN2CTSK
SCHEMBL5773495 0.72 HTT (0.52) MEN1KMT2AHTTMAPK1
SCHEMBL17896292 0.71 MEN1 (0.44) MEN1KMT2ALMNAPDE10ANPY5R
SCHEMBL7958670 0.71 NPY5R (0.43) PDE10ANPY5RGFER
SCHEMBL112929 0.71 HTT (0.46) MEN1KMT2ALMNAPDE10ASMN1; SMN2
SCHEMBL17822430 0.70 LMNA (0.55) LMNANPY5RSMN1; SMN2CTSKHSD17B10
SCHEMBL17822445 0.70 LMNA (0.55) LMNANPY5RSMN1; SMN2CTSKHSD17B10
Hydrochloric Acid SCHEMBL17822431 0.69 LMNA (0.53) LMNANPY5RSMN1; SMN2CTSKHSD17B10
SCHEMBL6244302 0.68 MAPT (0.42) MEN1KMT2ALMNAGFERSMN1; SMN2
SCHEMBL2166459 0.68 HRH4 (0.51) KMT2A

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 5 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
EP-1054887-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS Amgen Inc. (US) 2000-11-29 EP disclosed
WO-1999040091-A1 BICYCLIC PYRIDINE AND PYRIMIDINE DERIVATIVES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS AMGEN INC. (US) 1999-08-12 WO disclosed