SCHEMBL377607

SCHEMBL377607

CNc1ccc(CN2CCN(C(=O)O)[C@@](C)(C(C)(C)C)C2)nc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.37
METTL3 Q86U44 2/20 0.36
HIF1A Q16665 1/20 0.34
EPAS1 Q99814 1/20 0.34
PPARG P37231 1/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34
FGFR3 P22607 1/20 0.33
MAPK7 Q13164 1/20 0.33
RET P07949 2/20 0.32
KDR P35968 1/20 0.32
MELK Q14680 1/20 0.32
CLK2 P49760 1/20 0.32
CLK3 P49761 1/20 0.32
DYRK1A Q13627 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
PDE7A Q13946 1/20 0.31
MAPK14 Q16539 1/20 0.31
HRH3 Q9Y5N1 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
SCHEMBL377425 0.83 RAB9A (0.40) FAAHHIF1AEPAS1KDM4EALDH1A1
SCHEMBL377693 0.83 RAB9A (0.40) FAAHHIF1AEPAS1KDM4EALDH1A1
SCHEMBL377621 0.79 CNR2 (0.36) RETKDRKDM4EALDH1A1NPSR1
SCHEMBL1998344 0.77 MLNR (0.44) FAAHKDM4EALDH1A1PRKAA2
SCHEMBL3565835 0.75 RAB9A (0.41) FAAHHIF1AEPAS1KDM4EALDH1A1
SCHEMBL377606 0.72 HIF1A (0.34) FAAHMETTL3HIF1AEPAS1PPARG
SCHEMBL377823 0.71 LMNA (0.44) KDM4EALDH1A1HRH3
SCHEMBL377467 0.71 LMNA (0.44) KDM4EALDH1A1HRH3
SCHEMBL1996929 0.71 KDM4E (0.46) KDM4EALDH1A1
SCHEMBL2767386 0.71 CCR1 (0.39) RXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2029538-B1 BENZYLPIPERAZINE DERIVATIVES AS MOTILIN RECEPTOR ANTAGONISTS GLAXO GROUP LTD (GB) 2012-01-25 EP disclosed
US-20110275815-A1 BENZYLPIPERAZINE DERIVATIVES AS MOTILIN RECEPTOR ANTAGONISTS SEAL JONATHAN THOMAS 2011-11-10 US disclosed
US-8012981-B2 Benzylpiperazine derivatives as motilin receptor agonists GLAXO GROUP LIMITED (GB) 2011-09-06 US 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-20110275815-A1 BENZYLPIPERAZINE DERIVATIVES AS MOTILIN RECEPTOR ANTAGONISTS GPR68, GPR52, GPR88 FAAH 1304/4885METTL3 3583/4885HIF1A 2464/4885

“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.