SCHEMBL13675928

SCHEMBL13675928

O=C(CCc1ccc(C(F)(F)F)cc1)Nc1ccc2c(c1)OCCO2

nearest known ligand 0.79

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.79
RAB9A P51151 4/20 0.72
NPC1 O15118 3/20 0.72
SMN1; SMN2 Q16637 2/20 0.72
TSHR P16473 1/20 0.68
ALDH1A1 P00352 3/20 0.64
NFKB1 P19838 1/20 0.62
NFKB2 Q00653 1/20 0.62
RELA Q04206 1/20 0.62
LMNA P02545 2/20 0.60
POLB P06746 2/20 0.60
MAPT P10636 1/20 0.60
TP53 P04637 1/20 0.57
HPGD P15428 1/20 0.57
MCHR1 Q99705 3/20 0.55
GAA P10253 1/20 0.55

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
SCHEMBL4004820 0.88 TRPV1 (1.00) TRPV1RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL13675932 0.87 RAB9A (0.71) TRPV1RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL13675927 0.86 RAB9A (0.77) TRPV1RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL13675944 0.85 TSHR (0.74) TRPV1RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL13676019 0.85 TRPV1 (0.81) TRPV1RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL14529166 0.85 RAB9A (0.79) TRPV1RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL13676062 0.84 TRPV1 (0.60) TRPV1RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL13676082 0.84 TRPV1 (0.60) TRPV1RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL13675986 0.84 TRPV1 (0.63) TRPV1RAB9ANPC1SMN1; SMN2TSHR
SCHEMBL13675930 0.84 RAB9A (0.77) TRPV1RAB9ANPC1SMN1; SMN2TSHR

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.