SCHEMBL3072984

SCHEMBL3072984

COCC(=O)n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNP P00491 3/20 0.51
BLM P54132 2/20 0.51
HBB P68871 2/20 0.51
USP2 O75604 1/20 0.51
TSHR P16473 1/20 0.51
EDNRA P25101 1/20 0.51
HTR2A P28223 1/20 0.51
RECQL P46063 1/20 0.51
HSD17B10 Q99714 1/20 0.51
XDH P47989 4/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
ALDH1A1 P00352 1/20 0.49
LMNA P02545 1/20 0.49
CYP3A4 P08684 1/20 0.49
NFKB1 P19838 1/20 0.49
VCP P55072 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HIF1A Q16665 1/20 0.49
TK1 P04183 2/20 0.49

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
SCHEMBL7765224 0.84 TK1 (0.57) PNPBLMHBBUSP2TSHR
SCHEMBL7094400 0.83 TK1 (0.50) PNPBLMHBBUSP2TSHR
SCHEMBL5694098 0.83 XDH (0.54) PNPBLMHBBUSP2TSHR
SCHEMBL16401839 0.81 MEN1 (0.51) PNPBLMHBBUSP2TSHR
SCHEMBL218668 0.81 XDH (0.53) PNPBLMHBBUSP2TSHR
SCHEMBL27541246 0.81 XDH (0.58) PNPBLMHBBUSP2TSHR
SCHEMBL27923065 0.81 XDH (0.55) PNPBLMHBBUSP2TSHR
SCHEMBL4446276 0.79 XDH (0.54) PNPBLMHBBUSP2TSHR
SCHEMBL5347874 0.79 PNP (0.50) PNPBLMHBBUSP2TSHR
SCHEMBL4655346 0.78 PNP (0.62) PNPBLMHBBUSP2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7790843-B2 Cypin polypeptide and fragments thereof RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2010-09-07 US disclosed
US-20080182970-A1 Using cypin in assays, diagnostics and treatment of cognitive disorders RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2008-07-31 US disclosed
US-7338769-B2 Methods for identifying agonists of cypin RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2008-03-04 US disclosed
US-20050214822-A1 Using cypin in assays, diagnostics and treatment of cognitive disorders RUTGERS, THE STATE UNIVERSITY OF NEV 2005-09-29 US disclosed