SCHEMBL679152

SCHEMBL679152

CCN(C[C@H]1CC[C@H](CC(=O)O)CC1)c1ncc(C(F)(F)F)cc1CN(Cc1cc(Cl)cc(C(F)(F)F)c1)c1ccn(C)n1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.35
CRHR1 P34998 1/20 0.34
PTGDR2 Q9Y5Y4 6/20 0.33
FAAH O00519 1/20 0.33
CETP P11597 2/20 0.33
TRPM8 Q7Z2W7 1/20 0.33
CYP3A4 P08684 3/20 0.32
TACR1 P25103 3/20 0.32
DGAT1 O75907 2/20 0.32
KCNH2 Q12809 1/20 0.32
LTC4S Q16873 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
SCHEMBL679151 1.00 FFAR4 (0.35) FFAR4CRHR1PTGDR2FAAHCETP
SCHEMBL681020 0.95 TACR1 (0.35) FFAR4PTGDR2CETPCYP3A4TACR1
SCHEMBL681019 0.95 TACR1 (0.35) FFAR4PTGDR2CETPCYP3A4TACR1
SCHEMBL680321 0.92 KDM4E (0.36) CRHR1PTGDR2FAAHCETPTRPM8
SCHEMBL680322 0.92 KDM4E (0.36) CRHR1PTGDR2FAAHCETPTRPM8
SCHEMBL680317 0.89 FFAR4 (0.36) FFAR4CRHR1PTGDR2FAAHCETP
SCHEMBL680316 0.89 FFAR4 (0.36) FFAR4CRHR1PTGDR2FAAHCETP
SCHEMBL681037 0.87 CETP (0.34) PTGDR2CETPKCNH2LTC4S
SCHEMBL681036 0.87 CETP (0.34) PTGDR2CETPKCNH2LTC4S
SCHEMBL680453 0.87 SLC6A2 (0.37) FFAR4CETPTRPM8CYP3A4TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8841478-B2 Method for preparing trans-{4-[(alkylamino) methyl]- cyclohexyl}acetic acid ester KOWA COMPANY, LTD. (JP) 2014-09-23 US disclosed
EP-2383253-B1 METHOD FOR MANUFACTURING TRANS-{4-[(ALKYL AMINO) METHYL]CYCLOHEXYL} ACETIC ESTER KOWA CO (JP) 2014-03-19 EP disclosed
US-20110288328-A1 METHOD FOR PREPARING TRANS-ACETIC ACID ESTER KOWA COMPANY, LTD. (JP) 2011-11-24 US disclosed
EP-2383253-A1 METHOD FOR MANUFACTURING TRANS-{4-Ý(ALKYL AMINO) METHYL¨CYCLOHEXYL} ACETIC ESTER Kowa Company, Ltd. (JP) 2011-11-02 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-20110288328-A1 METHOD FOR PREPARING TRANS-ACETIC ACID ESTER ACSL6, ACSL3, ACSL1 FFAR4 392/4885CRHR1 2579/4885PTGDR2 2631/4885

“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.