SCHEMBL9660775

SCHEMBL9660775

FC(F)(F)COc1ccc(NNC2=NCCS2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 4/20 0.44
NPC1 O15118 4/20 0.44
RAB9A P51151 2/20 0.44
MAPT P10636 2/20 0.42
ALOX12 P18054 2/20 0.42
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
TSHR P16473 2/20 0.40
GAA P10253 1/20 0.40
ALDH1A1 P00352 1/20 0.39
MEN1 O00255 1/20 0.39
PAX8 Q06710 1/20 0.39
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
HPGD P15428 3/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL9660813 0.82 SMN1; SMN2 (0.51) KMT2ASMN1; SMN2LMNANPC1RAB9A
SCHEMBL9660740 0.82 NPC1 (0.41) KMT2ASMN1; SMN2LMNANPC1RAB9A
SCHEMBL9660415 0.80 KMT2A (0.40) KMT2ASMN1; SMN2LMNANPC1RAB9A
SCHEMBL9660439 0.80 HPGD (0.41) KMT2ASMN1; SMN2LMNANPC1RAB9A
SCHEMBL9660896 0.77 HPGD (0.39) KMT2ASMN1; SMN2LMNANPC1RAB9A
SCHEMBL9661603 0.76 NPC1 (0.50) KMT2ASMN1; SMN2LMNANPC1RAB9A
SCHEMBL9660414 0.76 POLB (0.41) KMT2ASMN1; SMN2LMNANPC1RAB9A
SCHEMBL9660186 0.76 NPC1 (0.41) KMT2ASMN1; SMN2LMNANPC1RAB9A
SCHEMBL9661513 0.74 NPC1 (0.45) KMT2ASMN1; SMN2LMNANPC1RAB9A
SCHEMBL9660722 0.73 KMT2A (0.43) KMT2ASMN1; SMN2NPC1RAB9ACYP1A2

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
EP-0520274-A2 2-(-4-substituted-phenylhydrazino)-2-thiazoline and 2-(-4-substituted phenylazo)-2-thiazoline, their preparation and their use against ectoparasites BAYER AG (DE) 1992-12-30 EP disclosed