SCHEMBL9660927

SCHEMBL9660927

FC(F)(F)c1ccc(NNC2=NCCS2)c(Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.48
KMT2A Q03164 5/20 0.44
HPGD P15428 1/20 0.43
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
ADRA2A P08913 1/20 0.40
POLB P06746 2/20 0.40
RAB9A P51151 4/20 0.39
MEN1 O00255 3/20 0.39
GAA P10253 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ATM Q13315 1/20 0.35
PKM P14618 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
SCHEMBL9690119 0.89 ADRA2A (0.49) NPC1KMT2AHPGDALDH1A1ADRA2A
SCHEMBL9661610 0.85 NPC1 (0.49) NPC1KMT2AHPGDALDH1A1ADRA2A
SCHEMBL9661549 0.82 NPC1 (0.45) NPC1KMT2AHPGDALDH1A1MAPT
SCHEMBL9658734 0.77 HPGD (0.45) NPC1KMT2AHPGDALDH1A1MAPT
SCHEMBL9581049 0.77 KMT2A (0.61) NPC1KMT2AHPGDALDH1A1MAPT
SCHEMBL9690030 0.75 NPC1 (0.47) NPC1KMT2AALDH1A1MAPTPOLB
SCHEMBL9689472 0.73 HPGD (0.52) NPC1KMT2AHPGDALDH1A1POLB
SCHEMBL3161607 0.71 ALDH1A1 (0.53) KMT2AALDH1A1MAPTADRA2APOLB
SCHEMBL10839121 0.70 ATM (0.48) NPC1KMT2AHPGDALDH1A1MAPT
Hydrochloric Acid SCHEMBL5745586 0.70 ALDH1A1 (0.51) KMT2AALDH1A1MAPTADRA2APOLB

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