SCHEMBL8043892

SCHEMBL8043892

CC(C)(C)c1nnc(Sc2nc(C(F)(F)F)c(C(=O)O)s2)s1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.33
USP7 Q93009 1/20 0.32
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP3A4 P08684 1/20 0.31
GRIA2 P42262 1/20 0.30
GRIA4 P48058 1/20 0.30

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
SCHEMBL8032850 0.91 MAPT (0.37) MAPTALDH1A1POLBUSP7SMN1; SMN2
SCHEMBL8043918 0.84 MAPT (0.45) MAPTALDH1A1POLBUSP7MEN1
SCHEMBL8042100 0.81 MAPT (0.36) MAPTALDH1A1USP7SMN1; SMN2
SCHEMBL8042786 0.81 MAPT (0.37) MAPTALDH1A1POLBUSP7SMN1; SMN2
SCHEMBL8047155 0.81 MAPT (0.37) MAPTALDH1A1POLBUSP7MEN1
SCHEMBL8043579 0.79 MAPT (0.35) MAPTALDH1A1POLBUSP7
SCHEMBL8047154 0.79 MAPT (0.36) MAPTALDH1A1POLBUSP7KMT2A
SCHEMBL8046194 0.78 MAPT (0.34) MAPTALDH1A1USP7
SCHEMBL8041916 0.78 MAPT (0.35) MAPTALDH1A1SMN1; SMN2
SCHEMBL8032914 0.78 MAPT (0.35) MAPTALDH1A1POLBMEN1CYP1A2

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