SCHEMBL9728531

SCHEMBL9728531

Nc1cc(F)c(C(F)(F)C(F)(F)C(F)(F)F)cc1F

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL9728221 0.87 ALDH1A1 (0.34) KIF11ALDH1A1
SCHEMBL239597 0.78 KIF11 (0.45) KIF11ALDH1A1
SCHEMBL31069948 0.78 KIF11 (0.45) KIF11ALDH1A1
SCHEMBL1099578 0.71 ALDH1A1 (0.53) ALDH1A1
SCHEMBL24696688 0.69 KIF11 (0.32) KIF11ALDH1A1
SCHEMBL24711096 0.69 ALDH1A1 (0.34) ALDH1A1
SCHEMBL1588990 0.69 KIF11 (0.45) KIF11ALDH1A1
SCHEMBL9728471 0.67
SCHEMBL10739885 0.67 SMN1; SMN2 (0.32)
SCHEMBL30668472 0.66 KIF11 (0.42) KIF11ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0246061-B1 A BENZOYLUREA DERIVATIVE AND ITS PRODUCTION AND USE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-03-18 EP disclosed
EP-0246061-A2 A benzoylurea derivative and its production and use SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-11-19 EP disclosed