SCHEMBL1025908

SCHEMBL1025908

CCN(CCN(CC(=O)N(C)N1Cc2ccc(F)cc2C1)C(=O)CNc1cc(-c2noc(C)n2)ccc1C)C(=O)OC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
GPR119 Q8TDV5 1/20 0.34
POLB P06746 1/20 0.33
THRB P10828 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
MAPT P10636 1/20 0.32
KIT P10721 5/20 0.32
MAPK14 Q16539 1/20 0.32
HTR1D P28221 1/20 0.31
HTR1B P28222 1/20 0.31
HTR2A P28223 1/20 0.31
NPY2R P49146 1/20 0.31

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
SCHEMBL1029451 0.95 GPR119 (0.34) LMNAGPR119POLBTHRBHDAC1
SCHEMBL1029864 0.94 POLB (0.37) LMNAGPR119POLBTHRBMAPT
SCHEMBL1028761 0.93 LMNA (0.37) LMNAGPR119POLBTHRBMAPT
SCHEMBL1026128 0.92 ACKR3 (0.37) LMNAGPR119HDAC1HDAC8HDAC6
SCHEMBL1027466 0.92 MAPT (0.38) LMNAGPR119POLBTHRBMAPT
SCHEMBL1030178 0.90 OPRK1 (0.31) GPR119
SCHEMBL1027668 0.90 NPY2R (0.34) GPR119NPY2R
SCHEMBL1028441 0.89 LMNA (0.34) LMNAGPR119POLBTHRBHDAC1
SCHEMBL1025145 0.89 POLB (0.38) LMNAGPR119POLBTHRBMAPT
SCHEMBL1197419 0.89 CPT1A (0.36) LMNAGPR119HDAC1HDAC8HDAC6

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 LMNA 3028/4885GPR119 644/4885POLB 4635/4885
US-20110034440-A1 HOMOCYSTEINE SYNTHASE INHIBITOR BHMT, CBS, BHMT2 LMNA 2551/4885GPR119 2613/4885POLB 1266/4885

“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.