SCHEMBL8048309

SCHEMBL8048309

CS(=O)(=O)c1cnc(Sc2nnnn2-c2ccccc2)s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 12/20 0.52
LMNA P02545 6/20 0.52
HTT P42858 5/20 0.52
MAPT P10636 4/20 0.52
HSD17B10 Q99714 3/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
TP53 P04637 3/20 0.52
MAPK1 P28482 3/20 0.52
KMT2A Q03164 3/20 0.52
TSHR P16473 3/20 0.46
PKM P14618 2/20 0.46
HPGD P15428 2/20 0.46
KDM4E B2RXH2 1/20 0.46
GAA P10253 2/20 0.46
HKDC1 Q2TB90 1/20 0.44
PTGS2 P35354 1/20 0.43
POLB P06746 2/20 0.42
MEN1 O00255 1/20 0.42
EP300 Q09472 1/20 0.42
NPSR1 Q6W5P4 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
SCHEMBL8041809 0.90 SMN1; SMN2 (0.44) ALDH1A1LMNAHTTMAPTHSD17B10
SCHEMBL8032525 0.89 POLB (0.42) ALDH1A1LMNAHTTMAPTHSD17B10
SCHEMBL8050190 0.88 ALDH1A1 (0.40) ALDH1A1LMNAHTTMAPTHSD17B10
SCHEMBL8041899 0.88 RECQL (0.49) ALDH1A1LMNAHTTMAPTHSD17B10
SCHEMBL8033930 0.87 ALDH1A1 (0.39) ALDH1A1LMNAHTTMAPTHSD17B10
SCHEMBL8049857 0.87 EP300 (0.44) ALDH1A1LMNAHTTMAPTHSD17B10
SCHEMBL8042077 0.86 ALDH1A1 (0.39) ALDH1A1LMNAHTTMAPTHSD17B10
SCHEMBL8046366 0.86 PTGS2 (0.50) ALDH1A1LMNAHTTMAPTHSD17B10
SCHEMBL8042987 0.86 PTGS2 (0.50) ALDH1A1LMNAHTTMAPTHSD17B10
SCHEMBL8042407 0.86 PTGS2 (0.43) ALDH1A1LMNAHTTMAPTHSD17B10

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
US-6080772-A 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY SUGEN, INC. (US) 2000-06-27 US disclosed