SCHEMBL9901079

SCHEMBL9901079

CC(C)c1nc2cscc2nc1Cl

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 4/20 0.36
TDP1 Q9NUW8 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
SCHEMBL6305823 0.77 GLP1R (0.58) GLP1R
SCHEMBL6312005 0.77 TDP1 (0.58) GLP1RTDP1
SCHEMBL4311900 0.77 TDP1 (0.48) TDP1
SCHEMBL9925837 0.75
SCHEMBL20049288 0.69 ALDH1A1 (0.50) GLP1RTDP1
SCHEMBL20049121 0.69 NPC1 (0.40) GLP1RTDP1
SCHEMBL15647502 0.66 ALDH1A1 (0.54) TDP1
SCHEMBL20049324 0.66 CYP1A2 (0.42) GLP1RTDP1
SCHEMBL20049333 0.66 GLP1R (0.40) GLP1RTDP1
SCHEMBL4174147 0.66 TDP1 (0.39) GLP1RTDP1

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
WO-2012076966-A1 SUBSTITUTED THIENO [3,4-B] PYRAZINE COMPOUNDS LUPIN LIMITED (IN) 2012-06-14 WO disclosed
WO-2012076966-A1 SUBSTITUTED THIENO [3,4-B] PYRAZINE COMPOUNDS LUPIN LIMITED (IN) 2012-06-14 WO disclosed