SCHEMBL8047155

SCHEMBL8047155

CCc1nnc(Sc2nc(C(F)(F)F)c(C(=O)O)s2)s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.37
ALDH1A1 P00352 3/20 0.36
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
POLB P06746 3/20 0.32
GAA P10253 1/20 0.32
LMNA P02545 2/20 0.32
AGTR1 P30556 1/20 0.32
AGTR2 P50052 1/20 0.32
USP7 Q93009 1/20 0.32
KAT8 Q9H7Z6 1/20 0.32
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 0.30
KDM4E B2RXH2 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
OPRK1 P41145 1/20 0.30
HTT P42858 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL8047154 0.90 MAPT (0.36) MAPTALDH1A1KMT2APOLBGAA
SCHEMBL8041916 0.89 MAPT (0.35) MAPTALDH1A1AGTR1AGTR2RAB9A
SCHEMBL8043579 0.88 MAPT (0.35) MAPTALDH1A1POLBAGTR1AGTR2
SCHEMBL8046194 0.87 MAPT (0.34) MAPTALDH1A1USP7
SCHEMBL8032914 0.86 MAPT (0.35) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL8043964 0.86 MAPT (0.34) MAPTALDH1A1USP7
SCHEMBL8034362 0.85 F2 (0.39) MAPTALDH1A1POLBUSP7
SCHEMBL8044470 0.85 MAPT (0.33) MAPTALDH1A1POLBUSP7SMN1; SMN2
SCHEMBL8044461 0.85 SMN1; SMN2 (0.40) MAPTALDH1A1KMT2AMEN1POLB
SCHEMBL8043686 0.83 ALDH1A1 (0.37) MAPTALDH1A1KMT2AMEN1POLB

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