SCHEMBL8049853

SCHEMBL8049853

CS(=O)(=O)c1ccc2nc(Sc3nnc(CO)s3)sc2c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.46
ACP1 P24666 1/20 0.46
KMT2A Q03164 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
HTT P42858 1/20 0.45
ALDH1A1 P00352 7/20 0.44
CLK1 P49759 2/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44
MEN1 O00255 3/20 0.43
HSD17B10 Q99714 2/20 0.43
HPGD P15428 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
WNT3A P56704 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
SCHEMBL8044136 0.91 PKM (0.44) PKMACP1KMT2ASMN1; SMN2LMNA
SCHEMBL8046298 0.89 PKM (0.47) PKMACP1KMT2ASMN1; SMN2LMNA
SCHEMBL8045974 0.88 ALDH1A1 (0.47) PKMACP1KMT2ASMN1; SMN2LMNA
SCHEMBL8046571 0.87 PKM (0.45) PKMACP1KMT2ASMN1; SMN2LMNA
SCHEMBL8043158 0.87 PKM (0.46) PKMACP1KMT2ASMN1; SMN2LMNA
SCHEMBL8050213 0.86 PKM (0.44) PKMACP1KMT2ASMN1; SMN2LMNA
SCHEMBL8042929 0.86 PKM (0.44) PKMACP1KMT2ASMN1; SMN2LMNA
SCHEMBL8042663 0.86 ACP1 (0.44) PKMACP1KMT2ASMN1; SMN2LMNA
SCHEMBL8047129 0.84 KMT2A (0.49) PKMACP1KMT2ASMN1; SMN2LMNA
SCHEMBL8044317 0.84 KMT2A (0.48) PKMACP1KMT2ASMN1; SMN2LMNA

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