SCHEMBL8032375

SCHEMBL8032375

O=C(O)c1sc(Sc2nnnn2-c2ccc(Br)s2)nc1C(F)(F)F

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.33
MAPT P10636 3/20 0.31
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL8043090 0.88 MAPT (0.35) ALDH1A1MAPTLMNATP53MAPK1
SCHEMBL8713628 0.85 ALDH1A1 (0.35) ALDH1A1MAPTLMNATP53MAPK1
SCHEMBL8048302 0.84 KMT2A (0.39) ALDH1A1MAPTLMNATP53MAPK1
SCHEMBL8034587 0.84 RECQL (0.37) ALDH1A1MAPTLMNAMAPK1HTT
SCHEMBL8033650 0.84 ALDH1A1 (0.34) ALDH1A1MAPTLMNATP53MAPK1
SCHEMBL8043982 0.83 ALDH1A1 (0.47) ALDH1A1MAPTLMNATP53MAPK1
SCHEMBL8049019 0.81 RECQL (0.47) ALDH1A1MAPTLMNATP53MAPK1
SCHEMBL8032724 0.81 MAPT (0.33) ALDH1A1MAPTLMNATP53MAPK1
SCHEMBL8046748 0.79 RECQL (0.39) ALDH1A1MAPTLMNATP53MAPK1
SCHEMBL8042019 0.79 ALDH1A1 (0.39) ALDH1A1MAPTLMNATP53MAPK1

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 2 patents. 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
WO-1998027092-A1 THIAZOLE COMPOUNDS AND METHODS OF MODULATING SIGNAL TRANSDUCTION SUGEN, INC. (US) 1998-06-25 WO disclosed