SCHEMBL9660769

SCHEMBL9660769

NN(C1=NCCS1)c1ccc(OCC(F)(F)F)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.36
ALDH1A1 P00352 5/20 0.36
ATM Q13315 1/20 0.36
NPC1 O15118 3/20 0.34
RAB9A P51151 2/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
SCN5A Q14524 1/20 0.33
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 4/20 0.32
LMNA P02545 3/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
KDM4C Q9H3R0 1/20 0.31

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
SCHEMBL9660809 0.82 APP (0.40) MAPTSMN1; SMN2LMNAGAATSHR
SCHEMBL9660733 0.82 NISCH (0.39) MAPTALDH1A1ATMNPC1RAB9A
SCHEMBL9660892 0.77 ALDH1A1 (0.31) MAPTALDH1A1ATM
SCHEMBL9661596 0.76 SMN1; SMN2 (0.39) MAPTALDH1A1ATMNPC1RAB9A
SCHEMBL9660409 0.76 ALDH1A1 (0.32) ALDH1A1
SCHEMBL9660718 0.73 ALDH1A1 (0.40) ALDH1A1LMNATSHR
SCHEMBL9660750 0.71 ALDH1A1 (0.44) ALDH1A1SMN1; SMN2LMNATSHRNPSR1
SCHEMBL11747051 0.71 ALDH1A1 (0.53) MAPTALDH1A1NPC1RAB9AKMT2A
SCHEMBL9689465 0.70 NOTUM (0.32) MAPTALDH1A1ATMNPC1RAB9A
SCHEMBL9660856 0.70 SCN5A (0.38) MAPTALDH1A1ATMNPC1RAB9A

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