SCHEMBL13675847

SCHEMBL13675847

CC1CN(c2nc(C(F)(F)F)ccc2/C=C/C(=O)Nc2ccc3c(c2)OCCO3)CC(C)N1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 16/20 0.74
MEN1 O00255 4/20 0.48
MAPT P10636 4/20 0.48
RAB9A P51151 4/20 0.48
KMT2A Q03164 4/20 0.48
SMN1; SMN2 Q16637 4/20 0.48
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
MTOR P42345 1/20 0.48
NPC1 O15118 3/20 0.47
NFKB1 P19838 2/20 0.47
NFKB2 Q00653 2/20 0.47
RELA Q04206 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
MCHR1 Q99705 1/20 0.46
POLB P06746 1/20 0.45

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
SCHEMBL14566172 0.91 TRPV1 (0.61) TRPV1MEN1MAPTRAB9AKMT2A
SCHEMBL13675840 0.85 TRPV1 (0.84) TRPV1MEN1MAPTRAB9AKMT2A
SCHEMBL13675800 0.85 TRPV1 (1.00) TRPV1MEN1MAPTRAB9AKMT2A
SCHEMBL3997117 0.85 TRPV1 (1.00) TRPV1MEN1MAPTRAB9AKMT2A
SCHEMBL13675845 0.83 TRPV1 (0.51) TRPV1MCHR1
SCHEMBL13675846 0.83 TRPV1 (0.52) TRPV1MEN1RAB9AKMT2ANPC1
SCHEMBL4000608 0.82 TRPV1 (1.00) TRPV1MEN1MAPTRAB9AKMT2A
SCHEMBL13676180 0.80 ALDH1A1 (0.48) TRPV1MEN1MAPTRAB9AKMT2A
SCHEMBL3995088 0.74 TRPV1 (0.84) TRPV1MEN1MAPTRAB9AKMT2A
SCHEMBL3996198 0.72 TRPV1 (0.72) TRPV1MEN1MAPTRAB9AKMT2A

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 7 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

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 1/4885MEN1 3504/4885MAPT 755/4885

“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.