SCHEMBL13865826

SCHEMBL13865826

Cc1cccc2c1nc(-c1cccc3c1CN(C(C)C(C)CCC(C)C)C3=O)c(=O)n2C

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.32
▸ PKM P14618 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ PDE5A O76074 1/20 0.30

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
SCHEMBL14175937 0.90 MAPT (0.31) MAPTPKM
SCHEMBL13865824 0.83 MAPT (0.31) MAPTPKM
SCHEMBL28736752 0.65 ALDH1A1 (0.63) MAPTMAPK1
SCHEMBL13865822 0.64 MAPT (0.38) MAPTPKMMAPK1RAB9AATM
SCHEMBL6753980 0.62 TLR8 (0.40) MAPTPKMMAPK1RAB9A
SCHEMBL13865840 0.60 MAPT (0.40) MAPTMAPK1RAB9AATM
SCHEMBL6755245 0.60 TLR8 (0.41) MAPTPKMMAPK1RAB9A
SCHEMBL13865832 0.60 KDM4E (0.35) MAPTPKMMAPK1RAB9A
SCHEMBL6756151 0.59 PSEN1 (0.43) PKMRAB9A
SCHEMBL31448409 0.58 MAPT (0.71) MAPTPKMMAPK1RAB9A

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
US-20090137597-A1 Novel quinoxalinone derivatives MSD K.K. (JP) 2009-05-28 — — 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-20090137597-A1 Novel quinoxalinone derivatives NDUFB1, NDUFB6, NDUFB7 MAPT 4476/4885PKM 3565/4885MAPK1 786/4885

“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.

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