SCHEMBL785078

SCHEMBL785078

CN(C(=O)c1ccc(F)cc1Cl)C1CCc2ccc(C(=O)O)cc21

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 2/20 0.43
PYGL P06737 4/20 0.41
PDK2 Q15119 2/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
NPC1 O15118 2/20 0.39
HSD11B1 P28845 1/20 0.39
KDM4A O75164 1/20 0.38
KDM4C Q9H3R0 1/20 0.38
HTR2C P28335 1/20 0.36
KCNH2 Q12809 1/20 0.36
MCHR1 Q99705 1/20 0.36
ACHE P22303 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL785630 1.00 TRPM8 (0.43) TRPM8PYGLPDK2ALDH1A1HPGD
SCHEMBL784876 0.91 TRPM8 (0.43) TRPM8PYGLPDK2SLC6A2SLC6A4
SCHEMBL803768 0.91 TRPM8 (0.43) TRPM8PYGLPDK2SLC6A2SLC6A4
SCHEMBL803727 0.89 HPGD (0.40) TRPM8PYGLPDK2ALDH1A1HPGD
SCHEMBL803766 0.88 TRPM8 (0.47) TRPM8PYGLPDK2ALDH1A1HPGD
SCHEMBL785536 0.88 TRPM8 (0.47) TRPM8PYGLPDK2ALDH1A1HPGD
SCHEMBL786012 0.88 SLC6A2 (0.43) TRPM8PYGLPDK2ALDH1A1HPGD
SCHEMBL784944 0.88 SLC6A2 (0.43) TRPM8PYGLPDK2ALDH1A1HPGD
SCHEMBL785069 0.87 HPGD (0.49) TRPM8PYGLALDH1A1HPGD
SCHEMBL484622 0.87 HPGD (0.49) TRPM8PYGLALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8680159-B2 Bradykinin 1 receptor modulating compounds GRUENENTHAL GMBH (DE) 2014-03-25 US disclosed
US-20120071461-A1 Substituted Benzamide Compounds GRUENENTHAL GMBH (DE) 2012-03-22 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-20120071461-A1 Substituted Benzamide Compounds BDKRB1, BDKRB2, HRH2 TRPM8 180/4885PYGL 4635/4885PDK2 2401/4885

“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.