SCHEMBL5772074

SCHEMBL5772074

Cc1nc(Cl)c2nc(-c3ccc(F)cc3)cc-2[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD51 Q06609 1/20 0.41
PSD A5PKW4 2/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.38
ALOX15 P16050 1/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 3/20 0.38
TP53 P04637 1/20 0.38
GCGR P47871 3/20 0.36
MAPK14 Q16539 3/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPK13 O15264 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK11 Q15759 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL5772706 0.88 MEN1 (0.40) PSDMEN1KMT2ANPC1RAB9A
SCHEMBL5775897 0.88 MEN1 (0.45) RAD51MEN1KMT2ANPC1RAB9A
SCHEMBL5774543 0.85 ADORA1 (0.48) MEN1KMT2ARAB9AMAPTTP53
SCHEMBL5773790 0.83 KDM4E (0.48) MEN1KMT2ANPC1ALOX15RAB9A
SCHEMBL5774514 0.82 MEN1 (0.44) RAD51MEN1KMT2ANPC1ALOX15
SCHEMBL5772572 0.82 KMO (0.43) KMT2ANPC1RAB9AMAPT
SCHEMBL5776830 0.81 PSD (0.41) PSDMAPTKDM4EL3MBTL1GAA
SCHEMBL5774058 0.80 CSNK1A1 (0.43) MAPTTP53MAPK14MAPK13MAPK12
SCHEMBL5773374 0.78 MGAM (0.45) MGAMGAASIMGAM2
SCHEMBL5772068 0.76 XDH (0.47) MEN1KMT2ANPC1RAB9AMAPT

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