SCHEMBL1027668

SCHEMBL1027668

CCN(CCN(CC(=O)N(C)N1Cc2ccc(F)cc2C1)C(=O)CNc1cc(-c2nc(C)no2)ccc1C)C(=O)OC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NPY2R P49146 1/20 0.34
GPR119 Q8TDV5 1/20 0.34
OPRK1 P41145 1/20 0.30
ACKR3 P25106 1/20 0.30
PTPN1 P18031 1/20 0.30
AHCY P23526 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
SCHEMBL1028770 0.93 NPY2R (0.36) NPY2RGPR119OPRK1ACKR3AHCY
SCHEMBL1028518 0.92 ACKR3 (0.37) NPY2RGPR119ACKR3PTPN1
SCHEMBL1025908 0.90 LMNA (0.35) NPY2RGPR119
SCHEMBL1026528 0.87 NPY2R (0.32) NPY2ROPRK1AHCY
Hydrochloric Acid SCHEMBL1026983 0.86 NPY2R (0.32) NPY2ROPRK1AHCY
SCHEMBL1025930 0.85 ACKR3 (0.41) NPY2RGPR119ACKR3AHCY
SCHEMBL1029451 0.85 GPR119 (0.34) NPY2RGPR119ACKR3AHCY
Hydrochloric Acid SCHEMBL1029002 0.84 NPY2R (0.32) NPY2ROPRK1ACKR3
SCHEMBL1029864 0.84 POLB (0.37) GPR119OPRK1
SCHEMBL1030178 0.83 OPRK1 (0.31) GPR119OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8513235-B2 Homocysteine synthase inhibitor MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-08-20 US disclosed
EP-2486925-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION Mitsubishi Tanabe Pharma Corporation (JP) 2012-08-15 EP disclosed
US-20120196824-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-08-02 US disclosed
US-20110034440-A1 HOMOCYSTEINE SYNTHASE INHIBITOR MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-02-10 US disclosed
EP-2275404-A1 HOMOCYSTEINE SYNTHASE INHIBITOR Mitsubishi Tanabe Pharma Corporation (JP) 2011-01-19 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-20120196824-A1 THERAPEUTIC AGENT FOR CEREBRAL INFARCTION FABP7, TIMP3, MMP11 NPY2R 2353/4885GPR119 644/4885OPRK1 4421/4885
US-20110034440-A1 HOMOCYSTEINE SYNTHASE INHIBITOR BHMT, CBS, BHMT2 NPY2R 4843/4885GPR119 2613/4885OPRK1 4716/4885

“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.