SCHEMBL2071040

SCHEMBL2071040

O=C(O)C1CCN(c2ccc(Cl)c(F)c2)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 15/20 0.63
AKR1C3 P42330 1/20 0.51
FFAR4 Q5NUL3 1/20 0.49
MALT1 Q9UDY8 1/20 0.49
PDK2 Q15119 1/20 0.48
APAF1 O14727 1/20 0.47
NSD2 O96028 1/20 0.47
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
THRB P10828 1/20 0.47
CASP3 P42574 1/20 0.47
RECQL P46063 1/20 0.47
GALK1 P51570 1/20 0.47
KMT2A Q03164 1/20 0.47
HKDC1 Q2TB90 1/20 0.47
SENP8 Q96LD8 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
SENP6 Q9GZR1 1/20 0.47
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 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
SCHEMBL30754976 1.00 NOTUM (0.63) NOTUMAKR1C3FFAR4MALT1PDK2
SCHEMBL22655506 0.92 NOTUM (0.77) NOTUM
SCHEMBL22491862 0.92 NOTUM (0.77) NOTUM
SCHEMBL30656717 0.92 NOTUM (0.77) NOTUM
SCHEMBL31381202 0.88 NOTUM (0.63) NOTUMAKR1C3FFAR4MALT1
SCHEMBL5799877 0.86 NOTUM (0.60) NOTUMAKR1C3FFAR4PDK2
SCHEMBL2074272 0.86 NOTUM (0.83) NOTUMAKR1C3MAPTTHRBRECQL
SCHEMBL22655664 0.83 NOTUM (0.60) NOTUM
SCHEMBL30656783 0.83 NOTUM (0.60) NOTUM
SCHEMBL22491879 0.83 NOTUM (0.60) NOTUM

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 2450/4885AKR1C3 2453/4885FFAR4 202/4885

“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.