SCHEMBL6080253

SCHEMBL6080253

CNCc1c(C(=O)O)nc2c(OC)cccc2c1C

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.46
PDE10A Q9Y233 1/20 0.44
ADORA2A P29274 12/20 0.44
ALDH1A1 P00352 3/20 0.43
HPGD P15428 2/20 0.43
LMNA P02545 1/20 0.43
THRB P10828 1/20 0.43
MEN1 O00255 1/20 0.42
MAPT P10636 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL6079727 0.85 ADORA2A (0.48) KDM4EPDE10AADORA2AALDH1A1HPGD
SCHEMBL6080957 0.82 PDE10A (0.52) KDM4EPDE10AADORA2AALDH1A1HPGD
SCHEMBL6080920 0.77 PDE10A (0.50) KDM4EPDE10AADORA2AALDH1A1HPGD
SCHEMBL6081023 0.76 KDM4E (0.52) KDM4EPDE10AADORA2AALDH1A1HPGD
SCHEMBL6592578 0.75 HPGDS (0.47) KDM4EPDE10AADORA2AALDH1A1HPGD
SCHEMBL6081016 0.73 PDE10A (0.56) KDM4EPDE10AADORA2AALDH1A1HPGD
SCHEMBL6080975 0.70 TNKS (0.51) KDM4EPDE10AALDH1A1HPGDMEN1
SCHEMBL17966023 0.70 ADORA2A (0.61) ADORA2A
SCHEMBL6079920 0.68 HPGDS (0.47) KDM4EPDE10AALDH1A1HPGDLMNA
SCHEMBL6080248 0.68 HPGDS (0.47) KDM4EPDE10AADORA2AALDH1A1HPGD

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 KDM4E 1006/4885PDE10A 702/4885ADORA2A 1442/4885

“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.