SCHEMBL7819956

SCHEMBL7819956

COC(=O)c1cc(C(N)=O)nn1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 2/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPT P10636 2/20 0.42
LMNA P02545 2/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
HIF1A Q16665 1/20 0.42
NPC1 O15118 3/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
GSK3B P49841 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
KDM4E B2RXH2 2/20 0.40
FAAH O00519 1/20 0.39
SIRT6 Q8N6T7 1/20 0.39

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
SCHEMBL69696 0.87 MEN1 (0.44) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL20455602 0.86 MEN1 (0.42) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL15273734 0.84 MEN1 (0.43) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL1267001 0.84 KDM4E (0.45) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL29092152 0.83 PLA2G10 (0.49) PLA2G10MEN1KMT2ALMNAGSK3B
SCHEMBL3055353 0.83 MEN1 (0.45) MEN1KMT2AMAPTLMNAALDH1A1
SCHEMBL18904958 0.79 BAZ2B (0.53) PLA2G10MEN1KMT2AMAPTLMNA
SCHEMBL286598 0.79 CA12 (0.42) MAPTALDH1A1HPGDNPC1SMN1; SMN2
SCHEMBL14351941 0.77 PLA2G10 (0.44) PLA2G10MEN1KMT2AMAPTLMNA
Hydrochloric Acid SCHEMBL286597 0.77 CA12 (0.41) MAPTALDH1A1HPGDNPC1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1123296-A1 PYRAZOLOPYRIMIDINONE cGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION Pfizer Limited (GB) 2001-08-16 EP disclosed
WO-2000024745-A1 PYRAZOLOPYRIMIDINONE cGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER LIMITED (GB) 2000-05-04 WO disclosed