SCHEMBL2073585

SCHEMBL2073585

O=C(O)C1CCN(c2ccc(F)cc2Cl)CC1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 14/20 0.61
TDP1 Q9NUW8 1/20 0.49
GRM5 P41594 1/20 0.48
ALDH1A1 P00352 1/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
SCN9A Q15858 1/20 0.47
HSD11B1 P28845 1/20 0.47

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
SCHEMBL2073619 0.86 NOTUM (0.56) NOTUMTDP1GRM5
SCHEMBL2072056 0.84 NOTUM (0.83) NOTUMTDP1ALDH1A1LMNAHTT
SCHEMBL3436604 0.84 NOTUM (0.52) NOTUMTDP1LMNAHSD11B1
Hydrochloric Acid SCHEMBL5427235 0.82 GAA (0.59) NOTUMTDP1ALDH1A1HTTSCN9A
SCHEMBL1573476 0.81 NOTUM (0.57) NOTUM
SCHEMBL23536360 0.81 NOTUM (0.63) NOTUMTDP1LMNAHTT
SCHEMBL29932011 0.81 NOTUM (0.63) NOTUMTDP1LMNAHTT
SCHEMBL4403596 0.79 TDP1 (0.74) TDP1ALDH1A1HTT
SCHEMBL13893331 0.79 NOTUM (0.54) NOTUMTDP1HSD11B1
SCHEMBL5800932 0.79 NOTUM (0.81) NOTUMLMNAHTT

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
US-20110059979-A1 Piperidine/Cyclohexane Carboxamide Derivatives For Use as Vanilloid Receptor Modulators GLAXO GROUP LIMITED (GB) 2011-03-10 US disclosed
EP-1660481-A1 PIPERIDINE/CYCLOHEXANE CARBOXAMIDE DERIVATIVES FOR USE AS VANILLOID RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2006-05-31 EP disclosed
WO-2005016915-A1 PIPERIDINE/CYCLOHEXANE CARBOXAMIDE DERIVATIVES FOR USE AS VANILLOID RECEPTOR MODULATORS GLAXO GROUP LIMITED (GB) 2005-02-24 WO 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-20110059979-A1 Piperidine/Cyclohexane Carboxamide Derivatives For Use as Vanilloid Receptor Modulators TRPV1, CNR1, OPRM1 NOTUM 2450/4885TDP1 4475/4885GRM5 148/4885

“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.