SCHEMBL13675840

SCHEMBL13675840

CN1CCN(c2nc(C(F)(F)F)ccc2/C=C/C(=O)Nc2ccc3c(c2)OCCO3)CC1

nearest known ligand 0.84

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 16/20 0.84
SMN1; SMN2 Q16637 5/20 0.49
MEN1 O00255 4/20 0.49
MAPT P10636 4/20 0.49
RAB9A P51151 4/20 0.49
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 3/20 0.49
NPC1 O15118 3/20 0.49
NFKB1 P19838 2/20 0.49
NFKB2 Q00653 2/20 0.49
RELA Q04206 2/20 0.49
LMNA P02545 1/20 0.49
TSHR P16473 1/20 0.48
MAPK1 P28482 1/20 0.48
MTOR P42345 1/20 0.48
POLB P06746 1/20 0.47

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
SCHEMBL3997117 0.91 TRPV1 (1.00) TRPV1SMN1; SMN2MEN1MAPTRAB9A
SCHEMBL13675800 0.91 TRPV1 (1.00) TRPV1SMN1; SMN2MEN1MAPTRAB9A
SCHEMBL13675847 0.85 TRPV1 (0.74) TRPV1SMN1; SMN2MEN1MAPTRAB9A
SCHEMBL4000608 0.84 TRPV1 (1.00) TRPV1SMN1; SMN2MEN1MAPTRAB9A
SCHEMBL13675836 0.82 TRPV1 (0.57) TRPV1SMN1; SMN2MAPT
SCHEMBL13676172 0.79 TRPV1 (0.53) TRPV1SMN1; SMN2MAPTRAB9AKMT2A
SCHEMBL3995088 0.76 TRPV1 (0.84) TRPV1SMN1; SMN2MEN1MAPTRAB9A
SCHEMBL14566172 0.76 TRPV1 (0.61) TRPV1SMN1; SMN2MEN1MAPTRAB9A
SCHEMBL13675864 0.75 TRPV1 (0.71) TRPV1MEN1MAPTRAB9AKMT2A
SCHEMBL13675859 0.75 TRPV1 (0.71) TRPV1MAPTKMT2ANPC1LMNA

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 1/4885SMN1; SMN2 2515/4885MEN1 3504/4885

“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.