SCHEMBL13675828

SCHEMBL13675828

O=C(/C=C/c1ccc(C(F)(F)F)nc1N1CCCCC1)Nc1cnc2ccccc2c1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 10/20 0.71
KDM4E B2RXH2 2/20 0.51
NPC1 O15118 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HSD17B10 Q99714 2/20 0.51
TP53 P04637 2/20 0.51
RAB9A P51151 1/20 0.51
NAMPT P43490 2/20 0.45
CNR1 P21554 2/20 0.44
CNR2 P34972 2/20 0.44
SCN10A Q9Y5Y9 1/20 0.43
USP30 Q70CQ3 1/20 0.43
MAPT P10636 1/20 0.42
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL13675839 0.90 TRPV1 (0.58) TRPV1KDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL13151368 0.83 TRPV1 (1.00) TRPV1HSD17B10TP53NAMPTSCN10A
SCHEMBL13675813 0.79 TRPV1 (0.68) TRPV1TP53SCN10AMAPT
SCHEMBL13676166 0.79 TRPV1 (0.61) TRPV1KDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL13675798 0.79 TRPV1 (0.70) TRPV1KDM4ENPC1TP53RAB9A
SCHEMBL13675800 0.78 TRPV1 (1.00) TRPV1NPC1SMN1; SMN2RAB9AMAPT
SCHEMBL13675801 0.78 TRPV1 (0.71) TRPV1TP53SCN10AMAPT
SCHEMBL846143 0.78 MAPT (0.62) TRPV1KDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL846144 0.78 MAPT (0.62) TRPV1KDM4ENPC1SMN1; SMN2HSD17B10
SCHEMBL3103219 0.76 TRPV1 (0.59) TRPV1HSD17B10SCN10AMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090264424-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. 2009-10-22 US disclosed
US-20090264424-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS AMGEN INC. 2009-10-22 US disclosed
US-7582657-B2 Treating inflammatory and neuropathic pain, headache, arthritis, rheumatic diseases, osteoarthritis, inflammatory bowel disorders, eye disorders, bladder disorders, psoriasis, skin disorders, asthma, herpes simplex AMGEN INC. (US) 2009-09-01 US disclosed
US-7582657-B2 Treating inflammatory and neuropathic pain, headache, arthritis, rheumatic diseases, osteoarthritis, inflammatory bowel disorders, eye disorders, bladder disorders, psoriasis, skin disorders, asthma, herpes simplex AMGEN INC. (US) 2009-09-01 US disclosed
US-7579347-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-08-25 US disclosed
US-7579347-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2009-08-25 US disclosed
EP-1780196-A2 Pyridine derivatives for use as vanilloid receptor ligands Amgen, Inc (US) 2007-05-02 EP disclosed
EP-1764358-A2 Cyclic amides as vanilloid receptor ligands and their use in treatments of inflammatory and neuropathic pain Amgen, Inc (US) 2007-03-21 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-20090264424-A1 VANILLOID RECEPTOR LIGANDS AND THEIR USE IN TREATMENTS TRPV1, TRPV2, TRPV3 TRPV1 1/4885KDM4E 4114/4885NPC1 2982/4885

“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.