SCHEMBL3584425

SCHEMBL3584425

CC(=CC(F)(F)F)c1ccc(C(=O)Nc2ccc3c(c2)OCCN3)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.53
RAB9A P51151 14/20 0.46
NPC1 O15118 14/20 0.46
PKM P14618 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
PIR O00625 1/20 0.44
GSK3B P49841 1/20 0.44
HSF1 Q00613 1/20 0.44
SMN1; SMN2 Q16637 6/20 0.44
TP53 P04637 3/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
HSD17B10 Q99714 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
MAPT P10636 4/20 0.43
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL3584417 1.00 TRPV1 (0.53) TRPV1RAB9ANPC1PKMMEN1
SCHEMBL3584422 1.00 TRPV1 (0.53) TRPV1RAB9ANPC1PKMMEN1
SCHEMBL13757256 0.85 RAB9A (0.65) TRPV1RAB9ANPC1PKMMEN1
SCHEMBL13996052 0.85 TRPV1 (0.56) TRPV1RAB9ANPC1MEN1KMT2A
SCHEMBL13757251 0.84 TRPV1 (0.55) TRPV1RAB9ANPC1PKMMEN1
SCHEMBL13757210 0.84 TRPV1 (0.59) TRPV1RAB9ANPC1PKMMEN1
SCHEMBL13993370 0.79 TRPV1 (0.48) TRPV1RAB9ANPC1PKMMEN1
SCHEMBL13757208 0.77 TRPV1 (0.60) TRPV1RAB9ANPC1PKMMEN1
SCHEMBL13763500 0.77 TRPV1 (0.55) TRPV1RAB9ANPC1PKMPIR
SCHEMBL3587856 0.76 TRPV1 (0.52) TRPV1RAB9ANPC1PKMMEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100004222-A1 Amide Derivatives as Ion-Channel Ligands and Pharmaceutical Compositions and Methods of Using the Same RENOVIS, INC. (US) 2010-01-07 US claimed

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-20100004222-A1 Amide Derivatives as Ion-Channel Ligands and Pharmaceutical Compositions and Methods of Using the Same TRPV1, TRPA1, TRPV2 TRPV1 1/4885RAB9A 2452/4885NPC1 879/4885

“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.