SCHEMBL13675703

SCHEMBL13675703

COc1ccc(/C(=C\C(=O)Nc2ccc3c(c2)OCCO3)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.86

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 15/20 0.86
RAB9A P51151 5/20 0.65
NPC1 O15118 5/20 0.65
SMN1; SMN2 Q16637 4/20 0.65
PKM P14618 3/20 0.65
TP53 P04637 2/20 0.65
NFKB1 P19838 1/20 0.65
NFKB2 Q00653 1/20 0.65
RELA Q04206 1/20 0.65
MAPT P10636 4/20 0.60
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
TSHR P16473 1/20 0.60
MAPK1 P28482 1/20 0.60
MTOR P42345 1/20 0.60
ATM Q13315 1/20 0.54
ALDH1A1 P00352 2/20 0.53
GAA P10253 1/20 0.53
ALOX12 P18054 1/20 0.53
LMNA P02545 1/20 0.52

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
SCHEMBL13675680 0.93 TRPV1 (1.00) TRPV1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL13675701 0.91 TRPV1 (0.79) TRPV1RAB9ANPC1SMN1; SMN2PKM
SCHEMBL3998005 0.89 TRPV1 (1.00) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL3998011 0.89 TRPV1 (1.00) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL13675707 0.89 TRPV1 (0.91) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL13675709 0.88 TRPV1 (0.89) TRPV1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL4001617 0.88 TRPV1 (1.00) TRPV1RAB9ASMN1; SMN2MAPTMEN1
SCHEMBL13675708 0.88 TRPV1 (0.89) TRPV1RAB9ANPC1SMN1; SMN2MAPT
SCHEMBL13675705 0.87 TRPV1 (0.76) TRPV1RAB9ANPC1SMN1; SMN2PKM
SCHEMBL13675700 0.87 TRPV1 (1.00) TRPV1RAB9ASMN1; SMN2MAPTMEN1

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 1/4885RAB9A 1356/4885NPC1 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.