SCHEMBL4030637

SCHEMBL4030637

Cc1nc(Cc2ccc(F)c(F)c2)sc1C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 13/20 0.47
CHRM4 P08173 1/20 0.43
LMNA P02545 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
SCD O00767 3/20 0.42
CACNA1G O43497 1/20 0.41
CACNA1H O95180 1/20 0.41
CACNA1I Q9P0X4 1/20 0.41
KLKB1 P03952 1/20 0.41

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
SCHEMBL14108643 0.88 SMN1; SMN2 (0.51) CHRM4SCDCACNA1GCACNA1HCACNA1I
SCHEMBL27929449 0.85 SCD (0.53) GPR52LMNACYP1A2CYP3A4CYP2C19
SCHEMBL14109203 0.84 CDC7 (0.55) LMNA
SCHEMBL4025836 0.81 CHRM4 (0.43) GPR52CHRM4LMNACYP1A2CYP3A4
SCHEMBL4032013 0.79 KLKB1 (0.56) GPR52LMNACYP1A2CYP3A4CYP2C19
SCHEMBL14108608 0.78 CACNA1G (0.43) GPR52CHRM4SCDCACNA1GCACNA1H
SCHEMBL14108836 0.77 KDM4E (0.54) GPR52
SCHEMBL14109371 0.75 ALDH1A1 (0.48) GPR52CYP3A4
SCHEMBL14109160 0.73 CDC7 (0.52) LMNA
SCHEMBL18320904 0.72 SMN1; SMN2 (0.55) KLKB1

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-2054408-A2 HETEROCYCLIC COMPOUNDS SUITABLE FOR THE TREATMENT OF DISEASES RELATED TO ELEVATED LIPID LEVEL Novartis Ag (CH) 2009-05-06 EP claimed
WO-2008127349-A2 HETEROCYCLIC COMPOUNDS SUITABLE FOR THE TREATMENT OF DISEASES RELATED TO ELEVATED LIPID LEVEL NOVARTIS AG (CH) 2008-10-23 WO claimed
CN-101460476-B Organic compounds NOVARTIS AG 2013-12-04 CN disclosed