SCHEMBL8045490

SCHEMBL8045490

FC(F)(F)c1cc(-c2csc(Sc3nnn(CCc4ccccc4)n3)n2)cc(C(F)(F)F)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF4E P06730 1/20 0.36
LTA4H P09960 2/20 0.36
ALDH1A1 P00352 2/20 0.35
KMT2A Q03164 2/20 0.35
AR P10275 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
HTR1A P08908 1/20 0.34
HTR2A P28223 1/20 0.34
HTR7 P34969 1/20 0.34
TP53 P04637 1/20 0.34
SPHK2 Q9NRA0 1/20 0.33
SPHK1 Q9NYA1 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
MAPT P10636 2/20 0.33
ALOX15 P16050 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SIGMAR1 Q99720 1/20 0.33

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
SCHEMBL8033189 0.91 RAB9A (0.38) EIF4ELTA4HALDH1A1KMT2AAR
SCHEMBL8048789 0.87 HTR1A (0.45) LTA4HALDH1A1KMT2AARKDM4E
SCHEMBL8050993 0.84 CTSS (0.36) EIF4ELTA4HARHTR1AHTR2A
SCHEMBL8050819 0.83 F2RL3 (0.36) EIF4ELTA4HALDH1A1KMT2AAR
SCHEMBL8037022 0.83 HTT (0.38) EIF4ELTA4HALDH1A1KMT2AKDM4E
SCHEMBL8050186 0.82 ATP4A (0.35) ALDH1A1KMT2AARRAB9AMAPT
SCHEMBL8046628 0.82 AR (0.40) LTA4HKMT2AARKDM4EMEN1
SCHEMBL8048213 0.81 XPO1 (0.40) EIF4EALDH1A1KMT2AKDM4EMEN1
SCHEMBL8032747 0.80 F2RL3 (0.37) EIF4EALDH1A1KMT2AARKDM4E
SCHEMBL8042050 0.79 LMNA (0.42) ALDH1A1KMT2AMEN1HTR1AHTR2A

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