SCHEMBL7151817

SCHEMBL7151817

Nc1cnc(-c2cccc(Cl)c2)n(CC(=O)NC(Cc2ccccc2)C(=O)C(F)(F)C(=O)NCc2ccccc2)c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 20/20 1.00
CMA1 P23946 19/20 1.00
CTSG P08311 1/20 1.00

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
SCHEMBL6556119 0.90 CTRC (1.00) CTRCCMA1CTSG
SCHEMBL8605012 0.90 CTRC (1.00) CTRCCMA1CTSG
SCHEMBL7157284 0.85 CMA1 (0.74) CTRCCMA1CTSG
SCHEMBL6558180 0.85 CTRC (0.82) CTRCCMA1CTSG
SCHEMBL6556271 0.85 CTRC (1.00) CTRCCMA1
SCHEMBL6558220 0.85 CTRC (0.91) CTRCCMA1CTSG
SCHEMBL6556352 0.84 CTRC (1.00) CTRCCMA1
SCHEMBL6558267 0.83 CTRC (1.00) CTRCCMA1
SCHEMBL6558270 0.83 CTRC (1.00) CTRCCMA1
SCHEMBL6556475 0.83 CTRC (1.00) CTRCCMA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6528514-B1 Pyrimidin-4-one-5-amino-3-alkylcarboxamidomethyl compounds WELFIDE CORPORATION (JP) 2003-03-04 US claimed
US-20090054319-A1 Methods and Compositions for the Treatment of Hypertension and Gastrointestinal Disorders MICROBIA, INC. (US) 2009-02-26 US disclosed
US-20090054319-A1 Methods and Compositions for the Treatment of Hypertension and Gastrointestinal Disorders MICROBIA, INC. (US) 2009-02-26 US disclosed
WO-2006102069-A2 METHODS AND COMPOSITIONS FOR THE TREATMENT OF HYPERTENSION AND GASTROINTESTINAL DISORDERS MICROBIA, INC. (US) 2006-09-28 WO disclosed
US-6528514-B1 Pyrimidin-4-one-5-amino-3-alkylcarboxamidomethyl compounds WELFIDE CORPORATION (JP) 2003-03-04 US disclosed
EP-1062949-A1 IgE ANTIBODY PRODUCTION INHIBITORS AND AUTOIMMUNE DISEASES INHIBITORS Welfide Corporation (JP) 2000-12-27 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-20090054319-A1 Methods and Compositions for the Treatment of Hypertension and Gastrointestinal Disorders PTGIS, PTGIR, GRPR CTRC 843/4885CMA1 313/4885CTSG 1249/4885

“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.