SCHEMBL7569894

SCHEMBL7569894

C=CCn1cnc2c(=O)[nH]cnc21

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 13/20 0.58
PNP P00491 2/20 0.51
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL9765190 0.82 HPRT1 (0.59) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL6428435 0.81 ADORA2B (0.52) HPRT1PNP
SCHEMBL24239249 0.79 HPRT1 (0.63) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL9192714 0.79 HPRT1 (0.51) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL1993930 0.79 HPRT1 (0.63) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL455645 0.78 HPRT1 (0.62) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL669006 0.78 TK1 (0.68) HPRT1PNPMEN1LMNAKMT2A
SCHEMBL11258920 0.76 HPRT1 (0.69) HPRT1PNP
SCHEMBL20782416 0.76 HPRT1 (0.65) HPRT1PNP
SCHEMBL22381490 0.75 HPRT1 (0.63) HPRT1PNPMEN1LMNAKMT2A

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-5734053-A CARDIOVASCULAR DISORDERS, HYPOTENSIVE AGENTS PFIZER INC (US) 1998-03-31 US disclosed
EP-0647227-B1 PURINONE ANTIANGINAL AGENTS PFIZER LTD (GB) 1996-10-09 EP disclosed
EP-0647227-A1 PURINONE ANTIANGINAL AGENTS. PFIZER LTD (GB) 1995-04-12 EP disclosed
WO-1994000453-A1 PURINONE ANTIANGINAL AGENTS PFIZER LIMITED (GB) 1994-01-06 WO disclosed