SCHEMBL22201622

SCHEMBL22201622

FC(F)(F)c1ccc(-c2cc3ncccc3c(Nc3ccc4nc(C5CC5)sc4c3)n2)cn1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.42
TRPV1 Q8NER1 8/20 0.42
PIK3CA P42336 4/20 0.39
PIK3CD O00329 1/20 0.39
PIK3CB P42338 1/20 0.39
PI4KA P42356 1/20 0.39
PIK3CG P48736 1/20 0.39
PI4KB Q9UBF8 1/20 0.39
KCNH2 Q12809 3/20 0.38
CYP2C19 P33261 1/20 0.36
AURKB Q96GD4 1/20 0.36
ULK1 O75385 1/20 0.35
ULK2 Q8IYT8 1/20 0.35

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
SCHEMBL22201366 0.86 MAPT (0.39) SYKCYP2C19
SCHEMBL22201327 0.86 SYK (0.40) SYKTRPV1PIK3CDULK1ULK2
SCHEMBL22201272 0.85 ULK1 (0.36) SYKTRPV1ULK1ULK2
SCHEMBL22201226 0.84 PRKCH (0.37) SYKKCNH2AURKB
SCHEMBL22201586 0.84 PRKCH (0.47) SYKKCNH2AURKB
SCHEMBL22201536 0.84 ACP1 (0.36) SYKCYP2C19ULK1ULK2
SCHEMBL22201423 0.84 TRPV1 (0.41) TRPV1ULK1ULK2
SCHEMBL22201271 0.84 SYK (0.38) SYKTRPV1ULK1ULK2
SCHEMBL22201323 0.84 SYK (0.38) SYKPIK3CGKCNH2CYP2C19AURKB
SCHEMBL22201273 0.83 SYK (0.37) SYKCYP2C19

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
WO-2020142748-A1 METHODS AND MATERIALS FOR INCREASING TRANSCRIPTION FACTOR EB POLYPEPTIDE LEVELS UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-07-09 WO disclosed