SCHEMBL4354840

SCHEMBL4354840

COCc1cc(Cl)c2ccc(-c3ncccc3C(F)(F)F)nc2n1

nearest known ligand 0.46

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 20/20 0.46
MAPK3 P27361 1/20 0.42

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
SCHEMBL4360051 0.87 TRPV1 (0.44) TRPV1MAPK3
SCHEMBL4362095 0.85 TRPV1 (0.56) TRPV1MAPK3
SCHEMBL4359911 0.84 TRPV1 (0.44) TRPV1MAPK3
SCHEMBL4355010 0.84 TRPV1 (0.48) TRPV1MAPK3
SCHEMBL4358524 0.84 TRPV1 (0.51) TRPV1MAPK3
SCHEMBL4352833 0.82 TRPV1 (0.52) TRPV1MAPK3
SCHEMBL4908576 0.82 TRPV1 (0.48) TRPV1MAPK3
SCHEMBL4354994 0.81 TRPV1 (0.57) TRPV1MAPK3
SCHEMBL13622817 0.81 TRPV1 (0.68) TRPV1MAPK3
SCHEMBL13622816 0.80 TRPV1 (0.60) TRPV1MAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090286767-A1 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2009-11-19 US disclosed
US-20090286767-A1 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2009-11-19 US disclosed
US-20090286767-A1 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2009-11-19 US disclosed
US-7488740-B2 Substituted quinolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2009-02-10 US disclosed
US-7488740-B2 Substituted quinolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2009-02-10 US disclosed
US-7488740-B2 Substituted quinolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2009-02-10 US disclosed
US-20070203133-A1 Substituted 5,12-diaza-benzoanthracene analogues NEUROGEN CORPORATION (US) 2007-08-30 US disclosed
US-20070105865-A1 Substituted bicyclic quinazolin-4-ylamine derivatives NEUROGEN CORPORATION (US) 2007-05-10 US disclosed
US-20070105865-A1 Substituted bicyclic quinazolin-4-ylamine derivatives NEUROGEN CORPORATION (US) 2007-05-10 US disclosed
US-20070105865-A1 Substituted bicyclic quinazolin-4-ylamine derivatives NEUROGEN CORPORATION (US) 2007-05-10 US disclosed
CN-1953979-A Substituted 5, 12-diaza-benzoanthracene analogues NEUROGEN CORP (US) 2007-04-25 CN disclosed
CN-1878771-A Substituted bicyclic quinazolin-4-ylamine derivatives NEUROGEN CORP (US) 2006-12-13 CN disclosed
EP-1723145-A2 SUBSTITUTED 5,12-DIAZA-BENZOANTHRACENE ANALOGUES NEUROGEN CORPORATION (US) 2006-11-22 EP disclosed
EP-1678173-A2 4-HETEROBICYCLYLAMINO-SUBSTITUTED QUINAZOLINES AND ANALOGUES THEREOF AS CAPSAICIN-ANTAGONISTS NEUROGEN CORPORATION (US) 2006-07-12 EP disclosed
EP-1644372-A2 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2006-04-12 EP disclosed
WO-2005086968-A2 SUBSTITUTED 5,12-DIAZA-BENZOANTHRACENE ANALOGUES NEUROGEN CORPORATION (US) 2005-09-22 WO disclosed
US-20050070547-A1 Substituted quinolin-4-ylamine analogues NEUROGEN CORPORATION 2005-03-31 US disclosed
WO-2005023807-A2 4 - HETEROBICYCLYAMINO - SUBSTITUTED QUINAZOLINES AND ANALOGUES THEROF AS CAPSAICIN - ANTAGONISTS NEUROGEN CORPORATION (US) 2005-03-17 WO disclosed
WO-2005007652-A2 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2005-01-27 WO 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 (4 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-20070105865-A1 Substituted bicyclic quinazolin-4-ylamine derivatives PIGS, HRH4, GPR35 TRPV1 244/4885MAPK3 3017/4885
US-20070203133-A1 Substituted 5,12-diaza-benzoanthracene analogues GPR52, SUCNR1, MC1R TRPV1 246/4885MAPK3 3743/4885
US-20090286767-A1 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES PIGS, HRH4, GPR52 TRPV1 279/4885MAPK3 3351/4885
US-20050070547-A1 Substituted quinolin-4-ylamine analogues PIGS, HRH4, GPR52 TRPV1 281/4885MAPK3 3441/4885

“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.