SCHEMBL9744243

SCHEMBL9744243

O=C(Nc1ccccc1)Nc1cc(F)ccc1C(=O)O

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 13/20 0.71
NPC1 O15118 3/20 0.68
RAB9A P51151 3/20 0.68
SMN1; SMN2 Q16637 3/20 0.68
HTT P42858 2/20 0.68
KDM4E B2RXH2 2/20 0.57
ALDH1A1 P00352 1/20 0.57
HPGD P15428 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
HSD17B10 Q99714 1/20 0.57
RCE1 Q9Y256 1/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
POLB P06746 1/20 0.54
TP53 P04637 1/20 0.53
EPHX1 P07099 1/20 0.53
TSHR P16473 1/20 0.53
EPHX2 P34913 1/20 0.53
CDK9 P50750 1/20 0.53
CLK4 Q9HAZ1 1/20 0.53

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
SCHEMBL6435289 0.91 GRIK1 (0.80) GRIK1NPC1RAB9ASMN1; SMN2HTT
SCHEMBL31078982 0.83 RAB9A (0.69) GRIK1NPC1RAB9ASMN1; SMN2HTT
SCHEMBL848085 0.82 AKR1C3 (0.60) GRIK1NPC1RAB9ASMN1; SMN2HTT
SCHEMBL5595292 0.82 GRIK1 (0.71) GRIK1NPC1RAB9ASMN1; SMN2HTT
SCHEMBL3957527 0.81 GRIK1 (1.00) GRIK1
SCHEMBL17609477 0.81 RAB9A (1.00) NPC1RAB9ASMN1; SMN2HTTKDM4E
SCHEMBL3962742 0.81 GRIK1 (1.00) GRIK1
SCHEMBL6431737 0.80 GRIK1 (1.00) GRIK1NPC1RAB9AKDM4EMEN1
SCHEMBL6677249 0.80 SMN1; SMN2 (0.66) GRIK1NPC1RAB9ASMN1; SMN2HTT
SCHEMBL1462332 0.80 KDM4E (0.71) GRIK1NPC1RAB9ASMN1; SMN2HTT

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
US-5093364-A 5-FLUOROANTHRANILIC FUNGICIDES SCHERING AGROCHEMICALS LIMITED (GB) 1992-03-03 US disclosed
EP-0360417-A2 Derivatives of 4-fluoroanthranilic acid and their use as fungicides SCHERING AGROCHEMICALS LIMITED (GB) 1990-03-28 EP disclosed