SCHEMBL14927587

SCHEMBL14927587

CCCN(C(=O)OC(C)(C)C)c1nc(Cl)c(C(=O)O)cc1F

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
CSNK2A2 P19784 1/20 0.32
CSNK2A1 P68400 1/20 0.32

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
SCHEMBL14927589 0.90 GRM2 (0.33) KEAP1NFE2L2
SCHEMBL14927585 0.89 ATR (0.36) KEAP1NFE2L2CSNK2A1
SCHEMBL14911315 0.86 KEAP1 (0.40) KEAP1NFE2L2
SCHEMBL14927570 0.82 KHK (0.39)
SCHEMBL14923502 0.82 KEAP1 (0.33) KEAP1NFE2L2
SCHEMBL14910422 0.79 ATR (0.35) KEAP1NFE2L2CSNK2A1
SCHEMBL14909331 0.79 CD38 (0.32) KEAP1NFE2L2
SCHEMBL14931090 0.77 GRM2 (0.36)
SCHEMBL14909095 0.77 ATR (0.38) CSNK2A1
SCHEMBL14910299 0.75 KDM4E (0.40)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8895585-B2 Nicotinamide derivative or salt thereof FUJIFILM CORPORATION (JP) 2014-11-25 US disclosed
US-8809371-B2 2014-08-19 US disclosed
US-8772320-B2 2014-07-08 US disclosed
US-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2013-05-09 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-20130116430-A1 NOVEL NICOTINAMIDE DERIVATIVE OR SALT THEREOF SYK, CD38, BTK KEAP1 1751/4885NFE2L2 2504/4885CSNK2A2 637/4885

“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.