SCHEMBL9728221

SCHEMBL9728221

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

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
KIF11 P52732 1/20 0.34

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
SCHEMBL9728531 0.87 KIF11 (0.32) ALDH1A1KIF11
SCHEMBL31069948 0.81 KIF11 (0.45) ALDH1A1KIF11
SCHEMBL239597 0.81 KIF11 (0.45) ALDH1A1KIF11
SCHEMBL1099578 0.74 ALDH1A1 (0.53) ALDH1A1
SCHEMBL24696688 0.72 KIF11 (0.32) ALDH1A1KIF11
SCHEMBL1588990 0.71 KIF11 (0.45) ALDH1A1KIF11
SCHEMBL30668472 0.69 KIF11 (0.42) ALDH1A1KIF11
SCHEMBL437730 0.69 KIF11 (0.47) ALDH1A1KIF11
SCHEMBL29746135 0.69 KIF11 (0.47) ALDH1A1KIF11
SCHEMBL9224858 0.69 KIF11 (0.42) ALDH1A1KIF11

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