SCHEMBL6952017

SCHEMBL6952017

C=CCc1nc(S)[nH]c1CO

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL11221244 0.79 NPSR1 (0.31) NPSR1
SCHEMBL9558520 0.72
SCHEMBL391560 0.64 NPSR1 (0.33) NPSR1
SCHEMBL11210558 0.64 NPSR1 (0.44) NPSR1
SCHEMBL11215137 0.64 CYP2C19 (0.31)
SCHEMBL5455757 0.63 NPSR1 (0.40) NPSR1
Hydrochloric Acid SCHEMBL11211543 0.63 NPSR1 (0.43) NPSR1
SCHEMBL252416 0.62
SCHEMBL3856071 0.62 NPSR1 (0.30) NPSR1
SCHEMBL7766629 0.59

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1255737-A4 PROCESS FOR PREPARING A 1-SUBSTITUTED 5-HYDROXYMETHYL IMIDAZOLE LG CHEM INVESTMENT LTD (KR) 2003-04-16 EP disclosed
EP-1255737-A1 PROCESS FOR PREPARING A 1-SUBSTITUTED 5-HYDROXYMETHYL IMIDAZOLE LG Chem Investment, Ltd. (KR) 2002-11-13 EP disclosed
WO-2001017974-A1 PROCESS FOR PREPARING A 1-SUBSTITUTED 5-HYDROXYMETHYL IMIDAZOLE LG CHEM INVESTMENT LTD. (KR) 2001-03-15 WO disclosed