SCHEMBL8043158

SCHEMBL8043158

CS(=O)(=O)c1ccc2nc(Sc3nnc(CC(N)=O)s3)sc2c1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.46
ACP1 P24666 1/20 0.45
ALDH1A1 P00352 7/20 0.44
KMT2A Q03164 3/20 0.44
HSD17B10 Q99714 2/20 0.44
MEN1 O00255 2/20 0.44
CLK1 P49759 3/20 0.43
SMN1; SMN2 Q16637 4/20 0.43
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
WNT3A P56704 1/20 0.43
CSNK1D P48730 1/20 0.42
TP53 P04637 2/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
KDM4E B2RXH2 1/20 0.41
TSHR P16473 1/20 0.41
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
SCHEMBL8045974 0.90 ALDH1A1 (0.47) PKMACP1ALDH1A1KMT2AHSD17B10
SCHEMBL8049853 0.87 PKM (0.46) PKMACP1ALDH1A1KMT2AHSD17B10
SCHEMBL8042947 0.86 ALDH1A1 (0.46) ACP1ALDH1A1KMT2AHSD17B10MEN1
SCHEMBL8046298 0.85 PKM (0.47) PKMACP1ALDH1A1KMT2AHSD17B10
SCHEMBL8044136 0.85 PKM (0.44) PKMACP1ALDH1A1KMT2AHSD17B10
SCHEMBL8042663 0.84 ACP1 (0.44) PKMACP1ALDH1A1KMT2AHSD17B10
SCHEMBL8046571 0.84 PKM (0.45) PKMACP1ALDH1A1KMT2AHSD17B10
SCHEMBL8050213 0.83 PKM (0.44) PKMACP1ALDH1A1KMT2AHSD17B10
SCHEMBL8042929 0.83 PKM (0.44) PKMACP1ALDH1A1KMT2AHSD17B10
SCHEMBL2093965 0.81 ACP1 (0.57) ACP1ALDH1A1KMT2AHSD17B10MEN1

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