SCHEMBL1028030

SCHEMBL1028030

CCN(CCN(CC(=O)N(C)N1Cc2cccc(F)c2C1)C(=O)CNc1ccc(-c2noc(C)n2)cc1C)C(=O)OC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.33
POLB P06746 1/20 0.33
ACKR3 P25106 7/20 0.33
LMNA P02545 2/20 0.33
NPY2R P49146 2/20 0.32
BDKRB1 P46663 1/20 0.31
KIFC1 Q9BW19 1/20 0.31
HTR1D P28221 1/20 0.31
HTR1B P28222 1/20 0.31
HTR2A P28223 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
MAPT P10636 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
SCHEMBL1028441 0.95 LMNA (0.34) GPR119POLBACKR3LMNANPY2R
SCHEMBL1025326 0.91 ACKR3 (0.33) ACKR3BDKRB1
SCHEMBL1029451 0.89 GPR119 (0.34) GPR119POLBACKR3LMNANPY2R
SCHEMBL1025145 0.89 POLB (0.38) GPR119POLBLMNAHTR1DHTR1B
SCHEMBL1197419 0.89 CPT1A (0.36) GPR119ACKR3LMNANPY2RBDKRB1
SCHEMBL1028556 0.87 HTR1D (0.33) POLBACKR3LMNABDKRB1KIFC1
SCHEMBL1028761 0.87 LMNA (0.37) GPR119POLBACKR3LMNAMAPT
Hydrochloric Acid SCHEMBL1026883 0.87 HTR1D (0.33) POLBACKR3LMNABDKRB1KIFC1
SCHEMBL1027816 0.86 GPR119 (0.36) GPR119ACKR3LMNANPY2RMAPT
SCHEMBL1027053 0.85 ACKR3 (0.34) GPR119ACKR3LMNAHDAC1HDAC8

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 GPR119 644/4885POLB 4635/4885ACKR3 1777/4885
US-20110034440-A1 HOMOCYSTEINE SYNTHASE INHIBITOR BHMT, CBS, BHMT2 GPR119 2613/4885POLB 1266/4885ACKR3 4604/4885

“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.