SCHEMBL5455696

SCHEMBL5455696

CCN(CC)c1nc(Nc2ccc(F)c(F)c2)nc(N2CCN(c3ncccc3C(F)(F)F)CC2C)n1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 9/20 0.45
GALR2 O43603 1/20 0.42
GALR1 P47211 1/20 0.42
RBP4 P02753 1/20 0.40
HSD11B1 P28845 3/20 0.40

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
SCHEMBL14581608 1.00 TRPV1 (0.45) TRPV1GALR2GALR1RBP4HSD11B1
SCHEMBL5451291 0.89 TRPV1 (0.46) TRPV1
SCHEMBL14581609 0.89 TRPV1 (0.46) TRPV1
SCHEMBL5456710 0.86 TERT (0.38) TRPV1HSD11B1
SCHEMBL14581613 0.86 TERT (0.38) TRPV1HSD11B1
SCHEMBL5445745 0.79 MALT1 (0.42)
SCHEMBL3880550 0.78 TRPV1 (0.51) TRPV1HSD11B1
SCHEMBL5444362 0.77 TRPV1 (0.56) TRPV1
SCHEMBL5792792 0.77 TRPV1 (0.56) TRPV1
SCHEMBL5456665 0.76 MAPK1 (0.46) GALR1

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-20070043049-A1 Substituted heterocyclic diarylamine analogues NEUROGEN CORPORATION (US) 2007-02-22 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-20070043049-A1 Substituted heterocyclic diarylamine analogues GPR35, NPY1R, BDKRB1 TRPV1 402/4885GALR2 34/4885GALR1 29/4885

“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.