SCHEMBL13675798

SCHEMBL13675798

O=C(/C=C/c1ccc(C(F)(F)F)nc1N1CCCCC1)Nc1ccc2ncsc2c1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 8/20 0.70
USP30 Q70CQ3 1/20 0.44
SCN10A Q9Y5Y9 1/20 0.43
MCHR1 Q99705 2/20 0.41
RAB9A P51151 2/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPT P10636 2/20 0.41
TP53 P04637 1/20 0.41
CHRM5 P08912 2/20 0.41
KDM4E B2RXH2 1/20 0.41
OTUD7B Q6GQQ9 1/20 0.40
CCKBR P32239 1/20 0.40
IKBKB O14920 1/20 0.39

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
SCHEMBL13675864 0.91 TRPV1 (0.71) TRPV1USP30MCHR1RAB9AMEN1
SCHEMBL13675843 0.91 TRPV1 (0.57) TRPV1USP30MCHR1RAB9AMEN1
SCHEMBL13675846 0.85 TRPV1 (0.52) TRPV1USP30MCHR1RAB9AMEN1
SCHEMBL3997657 0.83 TRPV1 (0.63) TRPV1USP30MCHR1RAB9AMEN1
SCHEMBL3997649 0.83 TRPV1 (0.63) TRPV1USP30MCHR1RAB9AMEN1
SCHEMBL13151368 0.82 TRPV1 (1.00) TRPV1SCN10AMCHR1MEN1KMT2A
SCHEMBL13675800 0.81 TRPV1 (1.00) TRPV1RAB9AMEN1NPC1POLB
SCHEMBL13675801 0.81 TRPV1 (0.71) TRPV1SCN10AMCHR1MAPTTP53
SCHEMBL13675813 0.80 TRPV1 (0.68) TRPV1SCN10AMCHR1MAPTTP53
SCHEMBL13675828 0.79 TRPV1 (0.71) TRPV1USP30SCN10ARAB9ANPC1

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 6 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

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 1/4885USP30 4190/4885SCN10A 546/4885

“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.