SCHEMBL4934743

SCHEMBL4934743

O=S(=O)(c1cccc(-c2cscn2)c1)n1cccc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KAT6A Q92794 1/20 0.45
MET P08581 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HTR6 P50406 4/20 0.36
SCN9A Q15858 1/20 0.36
KCNH2 Q12809 2/20 0.36
ALDH1A1 P00352 4/20 0.35
MAPT P10636 3/20 0.35
USP2 O75604 3/20 0.35
GAA P10253 3/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 2/20 0.35
ALOX15 P16050 1/20 0.35
LMNA P02545 4/20 0.35
HTT P42858 2/20 0.35
KDM4E B2RXH2 2/20 0.35
HIF1A Q16665 1/20 0.35
ESR1 P03372 1/20 0.34
GLA P06280 1/20 0.34
HTR1A P08908 1/20 0.34

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
SCHEMBL3674154 0.74 KAT6A (0.53) KAT6ASCN9A
SCHEMBL30042796 0.69 CYP19A1 (0.50) KAT6ASCN9A
SCHEMBL4518536 0.69 CYP19A1 (0.50) KAT6ASCN9A
SCHEMBL28189646 0.69 HTR6 (0.50) METHTR6ALDH1A1HPGDHSD17B10
SCHEMBL7389467 0.66 SCN9A (0.48) KAT6ASCN9AALDH1A1MAPTHPGD
SCHEMBL27732241 0.66 KAT6A (0.49) KAT6ASCN9AALDH1A1HSD17B10LMNA
SCHEMBL28844211 0.65 CDK8 (0.46) KAT6A
SCHEMBL5322690 0.64 RAB9A (0.54) KAT6ASCN9AALDH1A1MAPTGAA
SCHEMBL10151028 0.63 SCN9A (0.51) KAT6ASCN9AALDH1A1
SCHEMBL2789456 0.63 HSD17B1 (0.58) KAT6ASCN9A

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-1919474-A1 PYRROLOPYRIDINE DERIVATIVES AND USE OF SAME AS PPAR RECEPTOR MODULATORS Laboratoires Fournier S.A. (FR) 2008-05-14 EP disclosed
WO-2007026104-A1 PYRROLOPYRIDINE DERIVATIVES AND USE OF SAME AS PPAR RECEPTOR MODULATORS LABORATOIRES FOURNIER S.A. (FR) 2007-03-08 WO disclosed