SCHEMBL30003259

SCHEMBL30003259

COc1cccc2c1C(=O)C(Cl)=C(Cl)C2=O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.66
HTT P42858 2/20 0.66
RAB9A P51151 2/20 0.66
KDM4E B2RXH2 2/20 0.66
S1PR4 O95977 1/20 0.66
HSP90AA1 P07900 1/20 0.66
G6PD P11413 1/20 0.66
S1PR1 P21453 1/20 0.66
MAPK1 P28482 1/20 0.66
OPRK1 P41145 1/20 0.66
CACNA1B Q00975 1/20 0.66
APBA1 Q02410 1/20 0.66
MCL1 Q07820 1/20 0.66
NPSR1 Q6W5P4 1/20 0.66
APOBEC3G Q9HC16 1/20 0.66
TLR9 Q9NR96 1/20 0.66
EGFR P00533 1/20 0.60
PIM1 P11309 1/20 0.60
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57

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
SCHEMBL23271812 1.00 MAPT (0.66) MAPTHTTRAB9AKDM4ES1PR4
SCHEMBL9628316 0.88 MAPT (0.55) MAPTHTTRAB9AKDM4ES1PR4
SCHEMBL30003222 0.86 EGFR (0.54) MAPTHTTRAB9AKDM4ES1PR4
SCHEMBL23271950 0.86 EGFR (0.54) MAPTHTTRAB9AKDM4ES1PR4
SCHEMBL3417492 0.86 EGFR (0.76) MAPTHTTRAB9AKDM4EMAPK1
SCHEMBL8947495 0.84 EGFR (0.73) MAPTHTTRAB9AKDM4EEGFR
SCHEMBL7792566 0.82 EGFR (0.71) MAPTHTTRAB9AKDM4EMAPK1
SCHEMBL28575370 0.82 MEN1 (0.72) MAPTHTTRAB9AKDM4EMAPK1
SCHEMBL10974170 0.81 EGFR (0.74) MAPTHTTRAB9AKDM4ES1PR4
SCHEMBL5816933 0.81 EGFR (0.64) MAPTHTTRAB9AKDM4ES1PR4

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
CN-110891980-B Radical polymerization control agent and radical polymerization control method 川崎化成工业株式会社 2022-09-30 CN disclosed