SCHEMBL6804111

SCHEMBL6804111

Nc1cnc(-c2ccccc2)n(CC(=O)O)c1=O.[NaH]

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 11/20 0.53
CTRC Q99895 8/20 0.53
ELANE P08246 7/20 0.49
KDM4E B2RXH2 1/20 0.47
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL6239360 0.99 CMA1 (0.53) CMA1CTRCELANEKDM4EHSD17B10
Hydrochloric Acid SCHEMBL6805327 0.97 CMA1 (0.53) CMA1CTRCELANEKDM4EHSD17B10
SCHEMBL6804071 0.87 ELANE (0.50) CMA1CTRCELANEHSD17B10
SCHEMBL6804114 0.86 CMA1 (0.51) CMA1CTRCELANE
SCHEMBL6799136 0.86 ELANE (0.47) CMA1CTRCELANEHSD17B10
SCHEMBL6802606 0.86 ELANE (0.47) CMA1CTRCELANEKDM4EHSD17B10
SCHEMBL6803001 0.86 ELANE (0.60) CMA1CTRCELANE
SCHEMBL6810206 0.84 CTRC (0.50) CMA1CTRCELANE
SCHEMBL6804164 0.84 CMA1 (0.48) CMA1CTRCELANE
SCHEMBL30765599 0.84 CTRC (0.54) CMA1CTRCELANEKDM4EHSD17B10

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-20040063936-A1 Pyrimidine derivatives and process for preparing the same ONO PHARMACEUTICAL CO., LTD. (JP) 2004-04-01 US disclosed
EP-1346985-A1 PYRIMIDINE DERIVATIVES AND PROCESS FOR PREPARING THE SAME ONO PHARMACEUTICAL CO., LTD. (JP) 2003-09-24 EP 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-20040063936-A1 Pyrimidine derivatives and process for preparing the same DPYD, NUDT1, UMPS CMA1 1079/4885CTRC 2595/4885ELANE 4400/4885

“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.