SCHEMBL9700636

SCHEMBL9700636

Cc1ncc(CS(=O)(=O)n2c(Cl)nc3ccccc32)o1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH3A1 P30838 7/20 0.43
SMN1; SMN2 Q16637 3/20 0.41
TSHR P16473 3/20 0.38
ALDH1A1 P00352 2/20 0.38
HTT P42858 2/20 0.38
TP53 P04637 1/20 0.38
MAPK1 P28482 1/20 0.38
LMNA P02545 3/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GAA P10253 3/20 0.36
CXCL8 P10145 2/20 0.36
NOD2 Q9HC29 2/20 0.36
NOD1 Q9Y239 2/20 0.36
KDM4E B2RXH2 1/20 0.36
HPGD P15428 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PKM P14618 1/20 0.35
GALR3 O60755 1/20 0.35
NR2F2 P24468 1/20 0.35

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
SCHEMBL9699493 0.86 SMN1; SMN2 (0.39) ALDH3A1SMN1; SMN2TSHRALDH1A1HTT
SCHEMBL4991751 0.76 LMNA (0.45) ALDH3A1SMN1; SMN2TSHRALDH1A1HTT
SCHEMBL14263834 0.70 TNF (0.57) SMN1; SMN2TSHRALDH1A1HTTTP53
SCHEMBL7837246 0.70 SMN1; SMN2 (0.56) ALDH3A1SMN1; SMN2TSHRALDH1A1HTT
SCHEMBL28063595 0.67 SMN1; SMN2 (0.52) ALDH3A1SMN1; SMN2TSHRALDH1A1HTT
SCHEMBL21034360 0.67 SMN1; SMN2 (0.52) ALDH3A1SMN1; SMN2TSHRALDH1A1HTT
SCHEMBL3490377 0.67 SMN1; SMN2 (0.74) ALDH3A1SMN1; SMN2TSHRALDH1A1HTT
SCHEMBL8563059 0.66 HPGD (0.42) ALDH3A1TSHRALDH1A1HTTTP53
SCHEMBL9696683 0.62 GRIN1 (0.37) SMN1; SMN2ALDH1A1HTTMAPK1LMNA
SCHEMBL22462449 0.61 SMN1; SMN2 (0.66) ALDH3A1SMN1; SMN2TSHRALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992001687-A1 NOVEL OXAZOLYL DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1992-02-06 WO disclosed