SCHEMBL4975181

SCHEMBL4975181

NC(=O)c1ncc(-c2ncccc2Cl)cc1N

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.40
CNR2 P34972 1/20 0.39
NTRK1 P04629 1/20 0.39
RORB Q92753 1/20 0.39
MKNK1 Q9BUB5 2/20 0.38
MKNK2 Q9HBH9 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
CHEK2 O96017 2/20 0.37
MAP4K4 O95819 2/20 0.37
METAP2 P50579 1/20 0.37
GRM4 Q14833 2/20 0.36
MMP14 P50281 1/20 0.35
EIF4E P06730 1/20 0.35
IKBKB O14920 1/20 0.35
DOT1L Q8TEK3 1/20 0.35

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
SCHEMBL4973059 0.83 CYP2A6 (0.45) TRPV1CNR2MKNK1MKNK2CHEK2
SCHEMBL4974100 0.80 TRPV1 (0.51) TRPV1METAP2
SCHEMBL4809441 0.73 KDM4E (0.47) TRPV1NTRK1RORBSMN1; SMN2
SCHEMBL27635443 0.72 CYP2A6 (0.45) TRPV1CNR2
SCHEMBL30131336 0.71 SMN1; SMN2 (0.49) MKNK1MKNK2SMN1; SMN2GRM4IKBKB
SCHEMBL648916 0.71 SMN1; SMN2 (0.49) MKNK1MKNK2SMN1; SMN2GRM4IKBKB
SCHEMBL3924687 0.70 MKNK1 (0.42) MKNK1MKNK2SMN1; SMN2MAP4K4IKBKB
SCHEMBL699068 0.69 MKNK1 (0.49) MKNK1MKNK2SMN1; SMN2GRM4IKBKB
SCHEMBL29385675 0.69 MKNK1 (0.49) MKNK1MKNK2SMN1; SMN2GRM4IKBKB
SCHEMBL14108043 0.69 MKNK1 (0.47) TRPV1NTRK1RORBMKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1569925-A1 2-SUBSTITUTED QUINAZOLIN-4-YLAMINE ANALOGUES AS CAPSAICIN RECEPTOR MODULATORS NEUROGEN CORPORATION (US) 2005-09-07 EP claimed
WO-2004055003-A1 2-SUBSTITUTED QUINAZOLIN-4-YLAMINE ANALOGUES AS CAPSAICIN RECEPTOR MODULATORS NEUROGEN CORPORATION (US) 2004-07-01 WO claimed
US-20080015183-A1 SUBSTITUTED QUINAZOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2008-01-17 US disclosed
US-7304059-B2 Substituted quinazolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2007-12-04 US disclosed
US-20060173003-A1 Substituted quinazolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2006-08-03 US disclosed
US-7074799-B2 Substituted quinazolin-4-ylamine analogues NEUROGEN CORPORATION (US) 2006-07-11 US disclosed
EP-1581225-A1 COMBINATION THERAPY FOR THE TREATMENT OF PAIN NEUROGEN CORPORATION (US) 2005-10-05 EP disclosed
EP-1471910-A2 SUBSTITUTED QUINAZOLIN-4-YLAMINE ANALOGUES AS MODULATORS OF CAPSAICIN RECEPTORS NEUROGEN CORPORATION (US) 2004-11-03 EP disclosed
US-20040156869-A1 2-substituted quinazolin-4-ylamine analogues NEUROGEN CORPORATION 2004-08-12 US disclosed
US-20040142958-A1 Combination therapy for the treatment of pain NEUROGEN CORPORATION 2004-07-22 US disclosed
WO-2004054582-A1 COMBINATION THERAPY FOR THE TREATMENT OF PAIN NEUROGEN CORPORATION (US) 2004-07-01 WO disclosed
US-20040106616-A1 Substituted quinazolin-4-ylamine analogues NEUROGEN CORPORATION 2004-06-03 US disclosed
WO-2003062209-A2 SUBSTITUTED QUINAZOLIN-4-YLAMINE ANALOGUES AS MODULATORS OF CAPSAICIN NEUROGEN CORPORATION (US) 2003-07-31 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 (5 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-20080015183-A1 SUBSTITUTED QUINAZOLIN-4-YLAMINE ANALOGUES PIGS, HRH4, GPR88 TRPV1 244/4885CNR2 23/4885NTRK1 45/4885
US-20040142958-A1 Combination therapy for the treatment of pain OPRK1, OPRL1, OPRM1 TRPV1 36/4885CNR2 12/4885NTRK1 541/4885
US-20040156869-A1 2-substituted quinazolin-4-ylamine analogues PIGS, HRH4, GPR88 TRPV1 297/4885CNR2 17/4885NTRK1 41/4885
US-20060173003-A1 Substituted quinazolin-4-ylamine analogues PIGS, HRH4, GPR88 TRPV1 244/4885CNR2 23/4885NTRK1 45/4885
US-20040106616-A1 Substituted quinazolin-4-ylamine analogues PIGS, HRH4, GPR88 TRPV1 240/4885CNR2 21/4885NTRK1 36/4885

“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.