SCHEMBL9768197

SCHEMBL9768197

CC(/C=N/O)=N\Nc1c(Cl)cc(C(F)(F)F)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.36
ALDH1A1 P00352 5/20 0.36
HTT P42858 2/20 0.36
RAPGEF4 Q8WZA2 2/20 0.33
PDE2A O00408 1/20 0.33
KMT2A Q03164 2/20 0.32
MAPT P10636 5/20 0.32
KDM4E B2RXH2 4/20 0.32
LMNA P02545 2/20 0.32
HPGD P15428 2/20 0.32
ABCB1 P08183 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
OPRK1 P41145 1/20 0.31
RAB9A P51151 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PLAU P00749 1/20 0.31
TP53 P04637 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
SCHEMBL9768202 1.00 GAA (0.36) GAAALDH1A1HTTRAPGEF4PDE2A
SCHEMBL9218250 0.85 GAA (0.33) GAAALDH1A1HTTRAPGEF4PDE2A
SCHEMBL9768313 0.79 ALDH1A1 (0.33) GAAALDH1A1HTTKMT2AKDM4E
SCHEMBL9219630 0.78 ABCB1 (0.33) GAAALDH1A1HTTKMT2AMAPT
SCHEMBL27286601 0.77 GAA (0.39) GAAALDH1A1HTTRAPGEF4PDE2A
SCHEMBL9768157 0.77 ALDH1A1 (0.37) GAAALDH1A1KMT2AMAPTKDM4E
SCHEMBL9768163 0.77 ALDH1A1 (0.37) GAAALDH1A1KMT2AMAPTKDM4E
SCHEMBL7713546 0.75 ALDH1A1 (0.38) GAAALDH1A1HTTKMT2AMAPT
SCHEMBL6258551 0.75 RAPGEF3 (0.38) GAAALDH1A1HTTRAPGEF4PDE2A
SCHEMBL7713550 0.75 ALDH1A1 (0.38) GAAALDH1A1HTTKMT2AMAPT

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-5064844-A Miticides SCHERING AGROCHEMICALS LIMITED (GB) 1991-11-12 US disclosed