SCHEMBL6080192

SCHEMBL6080192

COC(=O)c1cc(O)c2cccc(N(C)C)c2n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.40
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
PTGER4 P35408 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
NQO2 P16083 3/20 0.39
GAA P10253 2/20 0.38
TSHR P16473 1/20 0.38
GABRP O00591 1/20 0.38

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
SCHEMBL6080552 0.85 KDM4E (0.43) KDM4EMAPTALDH1A1CA2GAA
SCHEMBL1401134 0.82 MAPT (0.45) LCKKDM4EMAPTPTGER4ALDH1A1
SCHEMBL1815489 0.81 MAPT (0.45) LCKKDM4EMAPTPTGER4ALDH1A1
SCHEMBL8292463 0.81 LCK (0.42) LCKKDM4EMAPTPTGER4ALDH1A1
SCHEMBL561666 0.81 PDE10A (0.47) LCKKDM4EMAPTPTGER4ALDH1A1
SCHEMBL2222961 0.81 ADORA2A (0.47) LCKKDM4EMAPTPTGER4ALDH1A1
SCHEMBL6080401 0.81 NQO2 (0.47) LCKKDM4EMAPTPTGER4ALDH1A1
SCHEMBL561823 0.78 L3MBTL1 (0.43) LCKKDM4EMAPTPTGER4ALDH1A1
SCHEMBL6080646 0.78 NOTUM (0.42) MAPTALDH1A1LMNAHPGDHSD17B10
SCHEMBL6080778 0.77 EGFR (0.46) KDM4EMAPTPTGER4ALDH1A1LMNA

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 LCK 1565/4885KDM4E 1006/4885MAPT 1575/4885

“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.