SCHEMBL6080862

SCHEMBL6080862

COC(=O)c1cc(O)c2cc(-c3ccc(OC)cc3)cc(OC)c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.44
ALDH1A1 P00352 4/20 0.43
ERN1 O75460 2/20 0.43
PLA2G2A P14555 2/20 0.42
KDM4E B2RXH2 3/20 0.42
HPGD P15428 2/20 0.42
CASP1 P29466 1/20 0.42
CASP7 P55210 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MAPK1 P28482 2/20 0.41
FYN P06241 1/20 0.41
ADORA3 P0DMS8 1/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
TP53 P04637 1/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40

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
SCHEMBL6080590 0.90 ALDH1A1 (0.45) L3MBTL1ALDH1A1PLA2G2AKDM4EHPGD
SCHEMBL6081303 0.89 DHODH (0.43) ALDH1A1PLA2G2AKDM4EHPGDHSD17B10
SCHEMBL6591608 0.89 MCL1 (0.51) ALDH1A1ERN1KDM4EHPGDMAPK1
SCHEMBL6080550 0.85 MAPT (0.45) ALDH1A1KDM4EHPGDMAPK1CYP1A2
SCHEMBL6080299 0.79 CNR2 (0.42) ALDH1A1ERN1KDM4EHPGDHSD17B10
SCHEMBL6079891 0.79 MCL1 (0.53) L3MBTL1ALDH1A1KDM4EHPGDMAPK1
SCHEMBL6595262 0.79 ALOX15 (0.51) L3MBTL1ALDH1A1KDM4ECYP1A2MCL1
SCHEMBL21044375 0.78 ALDH1A1 (0.54) ALDH1A1PLA2G2AKDM4EHPGDCASP1
SCHEMBL6080169 0.78 MAPT (0.41) L3MBTL1ALDH1A1ERN1KDM4EHSD17B10
SCHEMBL6080304 0.78 LCK (0.38) ALDH1A1KDM4EHPGDHSD17B10MAPK1

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-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 US claimed
US-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NEURO3D (FR) 2006-08-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060183909-A1 Compositions derived from quinoline and quinoxaline, preparation and use thereof NQO1, NQO2, RECQL L3MBTL1 4069/4885ALDH1A1 2726/4885ERN1 4194/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.