SCHEMBL8043896

SCHEMBL8043896

FC(F)(F)c1cccc(-n2nnnc2Sc2nccs2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.43
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CYP1A2 P05177 1/20 0.40
NOTUM Q6P988 3/20 0.40
FBP1 P09467 1/20 0.40
HTT P42858 2/20 0.39
PAX8 Q06710 1/20 0.39
PIP4K2C Q8TBX8 1/20 0.39
LRRK2 Q5S007 1/20 0.39
POLB P06746 1/20 0.38
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL8032540 0.81 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1MAPTTSHRNPSR1
SCHEMBL8045341 0.81 ALDH1A1 (0.49) SMN1; SMN2ALDH1A1MAPTTSHRNPSR1
SCHEMBL8048205 0.80 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1MAPTTSHRNPSR1
SCHEMBL8033936 0.78 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1MAPTTSHRNPSR1
SCHEMBL8041886 0.78 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1MAPTTSHRNPSR1
SCHEMBL8043685 0.78 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1MAPTTSHRNPSR1
SCHEMBL8033935 0.77 HSD17B10 (0.47) SMN1; SMN2ALDH1A1MAPTTSHRL3MBTL1
SCHEMBL8052209 0.77 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1MAPTTSHRNPSR1
SCHEMBL8046515 0.77 POLB (0.45) SMN1; SMN2ALDH1A1MAPTTSHRNPSR1
SCHEMBL8044697 0.76 HSD17B10 (0.43) SMN1; SMN2ALDH1A1MAPTTSHRNPSR1

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