SCHEMBL5728165

SCHEMBL5728165

CC(=O)Nc1cnc(-c2ccccc2)n(CC(=O)NC(Cc2ccccc2)C(=O)CCl)c1=O

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ELANE P08246 11/20 0.54
CTRC Q99895 7/20 0.54
CMA1 P23946 7/20 0.54
CASP1 P29466 1/20 0.49

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
SCHEMBL5728160 1.00 ELANE (0.54) ELANECTRCCMA1CASP1
SCHEMBL6110034 0.91 ELANE (0.57) ELANECTRCCMA1
SCHEMBL6110027 0.91 ELANE (0.57) ELANECTRCCMA1
SCHEMBL6555937 0.88 CTRC (0.70) ELANECTRCCMA1
Hydrochloric Acid SCHEMBL5728980 0.85 CMA1 (0.68) CTRCCMA1
Hydrochloric Acid SCHEMBL5728984 0.85 CMA1 (0.68) CTRCCMA1
SCHEMBL5728765 0.82 ELANE (0.55) ELANECTRCCMA1CASP1
SCHEMBL5728626 0.81 ELANE (0.71) ELANE
SCHEMBL5728623 0.81 ELANE (0.71) ELANE
SCHEMBL6710145 0.80 ELANE (0.47) ELANECTRCCMA1

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-20060270850-A1 Processes for preparation of pyrimidine derivatives and intermediates AJINOMOTO CO., INC. (JP) 2006-11-30 US disclosed
EP-1695967-A1 PROCESSES FOR PRODUCTION OF PYRIMIDINE DERIVATIVES AND INTERMEDIATES Ajinomoto Co., Inc. (JP) 2006-08-30 EP disclosed
US-20050176966-A1 Process for the preparation of pyrimidine derivative, intermediate therefor and process for the preparation thereof AJINOMOTO CO., INC. (JP) 2005-08-11 US disclosed
EP-1529778-A1 Production method of pyrimidine derivative, intermediate therefor Ajinomoto Co., Inc. (JP) 2005-05-11 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 (2 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-20050176966-A1 Process for the preparation of pyrimidine derivative, intermediate therefor and process for the preparation thereof DPYD, WEE1, DCXR ELANE 4520/4885CTRC 752/4885CMA1 1206/4885
US-20060270850-A1 Processes for preparation of pyrimidine derivatives and intermediates PDXK, RNASEL, DPYD ELANE 4219/4885CTRC 244/4885CMA1 632/4885

“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.