SCHEMBL8043915

SCHEMBL8043915

CCc1nnc(Sc2ncc(Cl)s2)s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 5/20 0.37
MAPK9 P45984 5/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RAB9A P51151 3/20 0.35
MAPT P10636 2/20 0.35
PKM P14618 1/20 0.35
NPC1 O15118 1/20 0.35
THRB P10828 1/20 0.33
MAPK10 P53779 1/20 0.33
ICAM1 P05362 2/20 0.33
SELE P16581 2/20 0.33
VCAM1 P19320 2/20 0.33
POLB P06746 2/20 0.31
MPI P34949 1/20 0.31
TP53 P04637 1/20 0.31
USP7 Q93009 1/20 0.31

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
SCHEMBL8043004 0.88 MAPK8 (0.39) MAPK8MAPK9KMT2AALDH1A1NPSR1
SCHEMBL8044324 0.86 ALDH1A1 (0.37) MAPK8MAPK9ALDH1A1MAPK10
SCHEMBL8043957 0.84 MAPK8 (0.33) MAPK8MAPK9MAPK10USP7
SCHEMBL8051775 0.83 POLB (0.40) MAPK8MAPK9KMT2AMEN1KDM4E
SCHEMBL8044265 0.81 MAPK8 (0.32) MAPK8MAPK9MAPK10
SCHEMBL8044476 0.79 MAPK8 (0.33) MAPK8MAPK9RAB9AMAPTPKM
SCHEMBL8042807 0.79 MEN1 (0.44) KMT2AMEN1ALDH1A1NPSR1RAB9A
SCHEMBL8043836 0.78 ICAM1 (0.40) MAPK8MAPK9ALDH1A1RAB9AMAPT
SCHEMBL8034054 0.78 F2 (0.44) MAPK8MAPK9ALDH1A1RAB9AMAPK10
SCHEMBL8034366 0.78 ALDH1A1 (0.45) KMT2AMEN1KDM4EALDH1A1RAB9A

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