SCHEMBL8028026

SCHEMBL8028026

CN(C)S(=O)(=O)n1c(C#N)nc2cc3c(cc21)OC(F)(Cl)C(F)(F)O3

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL6991338 0.92 KDM4E (0.36) KDM4EGAASMN1; SMN2
SCHEMBL8167767 0.82
SCHEMBL6996949 0.79
SCHEMBL7575344 0.77
SCHEMBL9077201 0.75 KDM4E (0.40) KDM4EGAASMN1; SMN2
SCHEMBL9077271 0.71 SMN1; SMN2 (0.42) KDM4EGAASMN1; SMN2
SCHEMBL9074842 0.71 SMN1; SMN2 (0.42) KDM4EGAASMN1; SMN2
SCHEMBL9394282 0.69 KDM4E (0.33) KDM4EGAASMN1; SMN2
SCHEMBL11013912 0.68 S1PR1 (0.42) KDM4EGAASMN1; SMN2
SCHEMBL10961029 0.68 SMN1; SMN2 (0.39) KDM4EGAASMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6103745-A USEFUL FOR HIGH FUNGICIDAL, INSECTICIDAL AND ACARICIDAL ACTIVITY BAYER AKTIENGESELLSCHAFT (DE) 2000-08-15 US disclosed
US-5932605-A Substituted benzimidazoles for pest control BAYER AKTIENGESELLSCHAFT (DE) 1999-08-03 US disclosed
EP-0758332-B1 SUBSTITUTED BENZIMIDAZOLES FOR PEST CONTROL BAYER AG (DE) 1999-07-07 EP disclosed
US-5731300-A FUNGICIDES, INSECTICIDES, ACARICIDES BAYER AKTIENGESELLSCHAFT (DE) 1998-03-24 US disclosed
EP-0758332-A1 SUBSTITUTED BENZIMIDAZOLES FOR PEST CONTROL BAYER AG (DE) 1997-02-19 EP disclosed
WO-1995030677-A1 SUBSTITUTED BENZIMIDAZOLES FOR PEST CONTROL BAYER AKTIENGESELLSCHAFT (DE) 1995-11-16 WO disclosed