SCHEMBL9316608

SCHEMBL9316608

N#Cn1c(-c2ccc(C(F)(F)F)cc2)cc(Cl)c1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 6/20 0.42
DYRK1A Q13627 1/20 0.38
DYRK2 Q92630 1/20 0.38
GABRP O00591 2/20 0.37
GABRD O14764 2/20 0.37
GABRA1 P14867 2/20 0.37
GABRB1 P18505 2/20 0.37
GABRG2 P18507 2/20 0.37
GABRB3 P28472 2/20 0.37
GABRA5 P31644 2/20 0.37
GABRA3 P34903 2/20 0.37
GABRA2 P47869 2/20 0.37
GABRB2 P47870 2/20 0.37
GABRA4 P48169 2/20 0.37
GABRE P78334 2/20 0.37
GABRA6 Q16445 2/20 0.37
GABRG1 Q8N1C3 2/20 0.37
GABRG3 Q99928 2/20 0.37
GABRQ Q9UN88 2/20 0.37
RAD51 Q06609 1/20 0.36

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
SCHEMBL10591696 0.70 KIF11 (0.44) KIF11NAAAADORA1KMT2A
SCHEMBL9316592 0.68 PTGS1 (0.37) RAD51NOTUMKMT2A
SCHEMBL9316197 0.67 AR (0.51) KIF11NOTUMKMT2A
SCHEMBL9684197 0.64 KIF11 (0.51) KIF11
SCHEMBL25302542 0.62 KIF11 (0.50) KIF11ADORA1KMT2A
SCHEMBL30510035 0.62 KIF11 (0.50) KIF11ADORA1KMT2A
SCHEMBL3908682 0.62 CYP3A4 (0.63) KIF11
SCHEMBL197238 0.61 KIF11 (0.78) KIF11
SCHEMBL29914837 0.61 KIF11 (0.78) KIF11
SCHEMBL13410633 0.61 KIF11 (0.78) KIF11

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
US-5310938-A Miticides, insecticides, parasiticides, and anthelmintics AMERICAN CYANAMID COMPANY (US) 1994-05-10 US claimed