SCHEMBL11160295

SCHEMBL11160295

CSc1nnc(Cc2cccnc2)c(=O)[nH]1

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GFER P55789 2/20 0.53
▸ HPGD P15428 1/20 0.53
▸ PLA2G7 Q13093 9/20 0.48
▸ DAO P14920 1/20 0.45
▸ LMNA P02545 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MMP2 P08253 1/20 0.40
▸ PDE7A Q13946 1/20 0.40

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
SCHEMBL10618910 0.78 PLA2G7 (0.71) PLA2G7
SCHEMBL10736202 0.76 GFER (0.57) GFERHPGDPLA2G7LMNAL3MBTL1
SCHEMBL10670202 0.75 DAO (0.49) DAOLMNA
SCHEMBL11160293 0.75 HPGD (0.46) GFERHPGDPLA2G7DAOL3MBTL1
SCHEMBL10622845 0.72 PLA2G7 (0.56) GFERHPGDPLA2G7DAOLMNA
SCHEMBL9224582 0.72 PNP (0.70) GFERHPGDPLA2G7
SCHEMBL10622902 0.71 LMNA (0.76) GFERHPGDPLA2G7DAOLMNA
SCHEMBL7371310 0.69 ALDH1A1 (0.50) GFERHPGDPLA2G7DAO
SCHEMBL10731082 0.68 PLA2G7 (0.54) GFERHPGDPLA2G7DAOLMNA
Hydrochloric Acid SCHEMBL7377500 0.68 ALDH1A1 (0.49) GFERHPGDPLA2G7DAO

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-4374836-A Antisecretory heterocyclic derivatives, process for their manufacture and pharmaceutical compositions containing them IMPERIAL CHEMICAL INDUSTRIES LTD. (GB) 1983-02-22 — — US disclosed
US-4220767-A HISTAMINE ANTAGONISTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1980-09-02 — — US disclosed
EP-0010894-A1 Antisecretory heterocyclic guanidine derivatives, process for their manufacture and pharmaceutical compositions containing them IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1980-05-14 — — EP disclosed
US-4185103-A ANTAGONISTS SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) 1980-01-22 — — US disclosed
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