SCHEMBL5442001

SCHEMBL5442001

FC(F)(F)c1ccc(Nc2nc(N3CCCCC3)nc(N3CCN(c4ncccc4Cl)CC3)n2)cc1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 11/20 0.55
MAPT P10636 1/20 0.54
IDH2 P48735 1/20 0.53
NPSR1 Q6W5P4 1/20 0.50
TRPA1 O75762 1/20 0.49

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
SCHEMBL5451132 0.96 TRPV1 (0.58) TRPV1MAPTTRPA1
SCHEMBL5443102 0.91 TRPV1 (0.56) TRPV1MAPTTRPA1
SCHEMBL5455549 0.90 TRPV1 (0.56) TRPV1MAPTNPSR1TRPA1
SCHEMBL5445649 0.90 TRPV1 (0.55) TRPV1TRPA1
SCHEMBL5454289 0.90 TRPV1 (0.55) TRPV1TRPA1
SCHEMBL5449461 0.86 TRPV1 (0.52) TRPV1TRPA1
SCHEMBL5442067 0.83 TRPV1 (0.55) TRPV1TRPA1
SCHEMBL5446802 0.82 LMNA (0.53) TRPV1MAPTIDH2NPSR1
SCHEMBL5444467 0.82 LMNA (0.53) TRPV1MAPTIDH2NPSR1
SCHEMBL5453975 0.81 TRPV1 (0.47) TRPV1TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651636-A1 SUBSTITUTED HETEROCYCLIC DIARYLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2006-05-03 EP claimed
WO-2005007646-A1 SUBSTITUTED HETEROCYCLIC DIARYLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2005-01-27 WO claimed
US-20070043049-A1 Substituted heterocyclic diarylamine analogues NEUROGEN CORPORATION (US) 2007-02-22 US disclosed
US-20070043049-A1 Substituted heterocyclic diarylamine analogues NEUROGEN CORPORATION (US) 2007-02-22 US disclosed
US-20070043049-A1 Substituted heterocyclic diarylamine analogues NEUROGEN CORPORATION (US) 2007-02-22 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-20070043049-A1 Substituted heterocyclic diarylamine analogues GPR35, NPY1R, BDKRB1 TRPV1 402/4885MAPT 4826/4885IDH2 1420/4885

“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.