SCHEMBL7961165

SCHEMBL7961165

Cc1nc(N2CCC(O)CC2)c2nc(-c3ccccc3)cc-2[nH]1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 7/20 0.56
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 2/20 0.43
GLA P06280 2/20 0.43
POLB P06746 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
LMNA P02545 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PIM1 P11309 3/20 0.41
CDC7 O00311 2/20 0.41
GSK3B P49841 2/20 0.41
AURKA O14965 2/20 0.41
PLK4 O00444 1/20 0.41
CHEK1 O14757 1/20 0.41
PDPK1 O15530 1/20 0.41
JAK2 O60674 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
Hydrochloric Acid SCHEMBL5773755 0.98 NPY5R (0.54) NPY5RKDM4EALDH1A1MEN1GLA
SCHEMBL5775242 0.93 NPY5R (0.49) NPY5RKDM4EALDH1A1MEN1GLA
SCHEMBL8126501 0.88 NPY5R (0.46) NPY5RKDM4EALDH1A1KITHPGD
SCHEMBL7963644 0.87 KDM4E (0.46) NPY5RKDM4EALDH1A1MEN1GLA
SCHEMBL5771896 0.87 NPY5R (0.52) NPY5RKDM4EKMT2AL3MBTL1HSD17B10
SCHEMBL5773349 0.87 NPY5R (0.52) NPY5RKDM4EKMT2AL3MBTL1HSD17B10
SCHEMBL5771652 0.86 MAPK8 (0.47) NPY5RKITHPGD
SCHEMBL5773681 0.85 NPY5R (0.54) NPY5RKDM4EKMT2AL3MBTL1HPGD
Hydrochloric Acid SCHEMBL5798034 0.85 KDM4E (0.45) NPY5RKDM4EALDH1A1MEN1GLA
SCHEMBL5772625 0.84 MELK (0.45) NPY5RKDM4EALDH1A1POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed