SCHEMBL18142145

SCHEMBL18142145

FC(F)(F)c1ccc(-c2ccc([C]c3ccc(-c4ccc(C(F)(F)F)cc4)cc3)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 16/20 0.68
MAOB P27338 1/20 0.45
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL2862671 0.92 KIF11 (0.56) KIF11ALDH1A1TSHR
SCHEMBL29914837 0.84 KIF11 (0.78) KIF11MAOBCA1CA2ALDH1A1
SCHEMBL197238 0.84 KIF11 (0.78) KIF11MAOBCA1CA2ALDH1A1
SCHEMBL13410633 0.84 KIF11 (0.78) KIF11MAOBCA1CA2ALDH1A1
SCHEMBL13063632 0.81 KIF11 (1.00) KIF11MAOB
SCHEMBL3456838 0.81 KIF11 (1.00) KIF11MAOB
SCHEMBL5927379 0.81 KIF11 (0.63) KIF11MAOB
SCHEMBL11589984 0.77 KIF11 (0.52) KIF11ALDH1A1TSHR
SCHEMBL2866711 0.76 PDE2A (0.44) KIF11ALDH1A1TSHR
SCHEMBL12937177 0.76 KIF11 (0.67) KIF11MAOBCA1CA2ALDH1A1

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-2275451-B1 Method for producing propylene-based copolymer MITSUI CHEMICALS INC (JP) 2016-10-19 EP disclosed