SCHEMBL8046536

SCHEMBL8046536

FC(F)(F)c1cc(-c2csc(Sc3nnnn3-c3nccs3)n2)cc(C(F)(F)F)c1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
HTT P42858 1/20 0.32
PAX8 Q06710 1/20 0.32
PIP4K2C Q8TBX8 1/20 0.32
EGFR P00533 1/20 0.31
KDR P35968 1/20 0.31
AR P10275 1/20 0.31
MAPT P10636 1/20 0.31
ALOX5 P09917 1/20 0.30
FBP1 P09467 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
SCHEMBL8050863 0.82 ALOX5 (0.35) KDM4EHTTPAX8PIP4K2CAR
SCHEMBL8043970 0.81 KMT2A (0.43) KDM4EHTTARMAPT
SCHEMBL8044497 0.81 HTT (0.33) KDM4EHTTPAX8PIP4K2CAR
SCHEMBL8043200 0.81 ALDH1A1 (0.43) KDM4EHTTMAPT
SCHEMBL8044748 0.80 TP53 (0.42) KDM4EHTTPIP4K2CARMAPT
SCHEMBL8033936 0.79 ALDH1A1 (0.42) KDM4EHTTPAX8PIP4K2CAR
SCHEMBL8043905 0.79 KDM4E (0.37) KDM4EHTTPAX8PIP4K2CMAPT
SCHEMBL8046511 0.79 HTT (0.45) HTTPAX8PIP4K2CMAPTALOX5
SCHEMBL8043675 0.79 KIT (0.39) KDM4EHTT
SCHEMBL8050841 0.78 ALDH1A1 (0.37) KDM4EHTTPAX8PIP4K2CMAPT

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