SCHEMBL7982268

SCHEMBL7982268

Cc1cc(N2CCCCC2)c2nc(-c3ccc(F)cc3)[nH]c2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 5/20 0.44
GAA P10253 2/20 0.41
NCF1 P14598 1/20 0.41
MGAM O43451 1/20 0.41
SI P14410 1/20 0.41
MGAM2 Q2M2H8 1/20 0.41
TNKS O95271 3/20 0.38
TNKS2 Q9H2K2 3/20 0.38
ALDH1A1 P00352 3/20 0.38
TP53 P04637 2/20 0.38
PARP2 Q9UGN5 1/20 0.38
PARP1 P09874 2/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
KDM4E B2RXH2 2/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL7968459 0.86 NPY5R (0.54) NPY5RGAANCF1ALDH1A1TP53
SCHEMBL7979823 0.85 POLB (0.43) NPY5RGAANCF1MGAMSI
SCHEMBL7978337 0.79 KMT2A (0.50) NPY5RNCF1ALDH1A1KDM4EMEN1
SCHEMBL29543334 0.75 MGAM (0.48) GAAMGAMSIMGAM2TNKS
SCHEMBL7981498 0.75 CBFB (0.45) NPY5RNCF1ALDH1A1TP53KDM4E
SCHEMBL7981521 0.74 NCF1 (0.36) NPY5RGAANCF1ALDH1A1KDM4E
SCHEMBL5774788 0.73 NPY5R (0.78) NPY5RNCF1
SCHEMBL7978430 0.72 METAP1 (0.36) NPY5RNCF1
SCHEMBL7968456 0.71 NCF1 (0.41) NPY5RGAANCF1ADORA2AADORA1
SCHEMBL10666376 0.71 LMNA (0.46) NPY5RALDH1A1KDM4EMAPK1HSD17B10

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-1003744-A1 4-AMINOPYRROLE(3,2-d) PYRIMIDINES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS Pfizer Products Inc. (US) 2000-05-31 EP claimed
WO-1999007703-A1 4-AMINOPYRROLE(3,2-d) PYRIMIDINES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 1999-02-18 WO claimed
US-6187778-B1 EATING AND CARDIOVASCULAR DISORDERS PFIZER INC. 2001-02-13 US disclosed
EP-1003744-A1 4-AMINOPYRROLE(3,2-d) PYRIMIDINES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS Pfizer Products Inc. (US) 2000-05-31 EP disclosed
WO-1999007703-A1 4-AMINOPYRROLE(3,2-d) PYRIMIDINES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 1999-02-18 WO disclosed