SCHEMBL21664602

SCHEMBL21664602

O=c1[nH]cc(N2Cc3ccncc3C2O)c(=O)[nH]1

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.37
▸ TIPARP Q7Z3E1 2/20 0.33
▸ GAA P10253 1/20 0.30
▸ ALDH1A1 P00352 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
SCHEMBL24717955 0.72 MEN1 (0.37) MAPTKDM4CGAAALDH1A1
SCHEMBL20128645 0.71 CYP11B2 (0.40) MAPTKDM4CTIPARPALDH1A1
SCHEMBL17169684 0.64 ALDH1A1 (0.43) MAPTKDM4CGAAALDH1A1
SCHEMBL23918999 0.64 MAPT (0.35) MAPTKDM4CGAA
SCHEMBL21477111 0.62 MAPT (0.35) MAPTKDM4CGAAALDH1A1
SCHEMBL20231586 0.62 MAPT (0.35) MAPTKDM4CGAA
SCHEMBL20128636 0.61 MAPT (0.39) MAPTKDM4C
SCHEMBL23350017 0.59 MAPT (0.35) MAPTKDM4CGAA
SCHEMBL20231587 0.59 MAPT (0.37) MAPTKDM4CGAAALDH1A1
SCHEMBL20128655 0.58 MAPT (0.39) MAPTKDM4CGAA

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-20200038513-A1 MODULATORS OF FAK PROTEOLYSIS AND ASSOCIATED METHODS OF USE YALE UNIVERSITY 2020-02-06 — — 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-20200038513-A1 MODULATORS OF FAK PROTEOLYSIS AND ASSOCIATED METHODS OF USE PTK2, CTTN, CRBN MAPT 2238/4885KDM4C 3739/4885TIPARP 324/4885

“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.

Send feedback