SCHEMBL8333788

SCHEMBL8333788

C[S+]([O-])c1nc2c(Cl)cc(F)c(N)c2s1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
ALDH1A1 P00352 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
SCHEMBL8334573 0.79 ALDH1A1 (0.35) SMN1; SMN2ALDH1A1
SCHEMBL8334566 0.77 TLR8 (0.36) SMN1; SMN2ALDH1A1
SCHEMBL9148367 0.77 SMN1; SMN2 (0.38) SMN1; SMN2ALDH1A1
SCHEMBL8312415 0.75 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1
Hydrochloric Acid SCHEMBL9147162 0.75 SMN1; SMN2 (0.37) SMN1; SMN2ALDH1A1
SCHEMBL8310400 0.74 MAPT (0.36) SMN1; SMN2ALDH1A1
SCHEMBL8329490 0.74 TLR8 (0.40) SMN1; SMN2ALDH1A1
SCHEMBL8331898 0.74 KDR (0.36) SMN1; SMN2ALDH1A1
SCHEMBL8335529 0.68
SCHEMBL8313967 0.68 MAPK14 (0.38)

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5888940-A DESICCATING PLANTS BASF AKTIENGESELLSCHAFT (DE) 1999-03-30 US disclosed
EP-0862569-A1 SUBSTITUTED BENZOTHIAZOLS WITH HERBICIDAL ACTION BASF AKTIENGESELLSCHAFT (DE) 1998-09-09 EP disclosed
WO-1997008171-A1 SUBSTITUTED BENZOTHIAZOLS WITH HERBICIDAL ACTION BASF AKTIENGESELLSCHAFT (DE) 1997-03-06 WO disclosed