SCHEMBL9660750

SCHEMBL9660750

NN(C1=NCCS1)c1ccc(S(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
LMNA P02545 2/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
KIF11 P52732 2/20 0.34
PTPRZ1 P23471 1/20 0.33
POLB P06746 1/20 0.33
JAK2 O60674 1/20 0.32
JAK1 P23458 1/20 0.32
TSHR P16473 1/20 0.32
PIP4K2A P48426 1/20 0.31
MBOAT4 Q96T53 1/20 0.30
ALDH3A1 P30838 1/20 0.30

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
SCHEMBL9660457 0.85 ALDH1A1 (0.39) ALDH1A1NPSR1
SCHEMBL9690703 0.84 ALDH1A1 (0.47) ALDH1A1LMNASMN1; SMN2NPSR1POLB
SCHEMBL9658792 0.81 ALDH1A1 (0.44) ALDH1A1NPSR1TSHR
SCHEMBL9660900 0.80 ALDH1A1 (0.42) ALDH1A1LMNASMN1; SMN2NPSR1POLB
SCHEMBL9661599 0.80 ALDH1A1 (0.42) ALDH1A1LMNANPSR1POLB
SCHEMBL9660717 0.78 NPC1 (0.44) ALDH1A1NPSR1KIF11TSHR
SCHEMBL9660718 0.74 ALDH1A1 (0.40) ALDH1A1LMNAHTTKIF11PTPRZ1
SCHEMBL11747051 0.72 ALDH1A1 (0.53) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL9661616 0.69 LMNA (0.37) ALDH1A1LMNAMAPK1HTTSMN1; SMN2
SCHEMBL9661614 0.69 LMNA (0.37) ALDH1A1LMNAMAPK1HTTSMN1; SMN2

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