SCHEMBL9660731

SCHEMBL9660731

NN(C1=NCCS1)c1ccc(S(=O)(=O)c2ccccc2)cc1C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.51
SFRP1 Q8N474 9/20 0.37
WNT3 P56703 2/20 0.37
NPSR1 Q6W5P4 2/20 0.35
HRH4 Q9H3N8 2/20 0.34
HTR6 P50406 1/20 0.34
PIK3CA P42336 1/20 0.34
KMT2A Q03164 3/20 0.33
POLB P06746 2/20 0.33
MAPT P10636 2/20 0.33
LMNA P02545 2/20 0.33
HTR2A P28223 1/20 0.33
KCNH2 Q12809 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 2/20 0.33

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
SCHEMBL9661599 0.85 ALDH1A1 (0.42) ALDH1A1NPSR1HRH4KMT2APOLB
SCHEMBL9660134 0.85 HRH4 (0.47) ALDH1A1NPSR1HRH4KMT2ALMNA
SCHEMBL9660737 0.73 KMT2A (0.41) ALDH1A1SFRP1WNT3HTR6KMT2A
SCHEMBL9658808 0.73 ALDH1A1 (0.37) ALDH1A1SFRP1WNT3HTR6POLB
SCHEMBL9658803 0.73 ALDH1A1 (0.37) ALDH1A1SFRP1WNT3HTR6POLB
SCHEMBL9660900 0.71 ALDH1A1 (0.42) ALDH1A1NPSR1HRH4KMT2APOLB
SCHEMBL10167004 0.70 SMN1; SMN2 (0.43) ALDH1A1SFRP1WNT3HRH4HTR6
SCHEMBL9690703 0.68 ALDH1A1 (0.47) ALDH1A1NPSR1POLBMAPTLMNA
SCHEMBL9660750 0.67 ALDH1A1 (0.44) ALDH1A1NPSR1POLBLMNASMN1; SMN2
SCHEMBL10167002 0.67 ESR1 (0.42) ALDH1A1SFRP1WNT3HTR6KMT2A

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