SCHEMBL4980648

SCHEMBL4980648

C=C(O)CNc1ncnc2ccccc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.62
RAB9A P51151 3/20 0.62
NR2F2 P24468 3/20 0.62
GALR3 O60755 2/20 0.62
SMN1; SMN2 Q16637 6/20 0.60
HTT P42858 5/20 0.60
LMNA P02545 4/20 0.60
KMT2A Q03164 3/20 0.60
GAA P10253 3/20 0.60
MAPK1 P28482 2/20 0.60
MAPT P10636 2/20 0.60
MEN1 O00255 1/20 0.60
TSHR P16473 1/20 0.60
APP P05067 1/20 0.59
KDM4E B2RXH2 2/20 0.55
ABCG2 Q9UNQ0 2/20 0.54
DAPK3 O43293 1/20 0.54
MAP4K4 O95819 1/20 0.54
ABL1 P00519 1/20 0.54
ERBB2 P04626 1/20 0.54

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
SCHEMBL4977976 0.86 SMN1; SMN2 (0.59) EGFRRAB9ANR2F2GALR3SMN1; SMN2
SCHEMBL15347754 0.84 LMNA (0.65) EGFRRAB9ANR2F2GALR3SMN1; SMN2
SCHEMBL8506287 0.78 HTT (0.59) EGFRRAB9ANR2F2GALR3SMN1; SMN2
SCHEMBL1520577 0.77 LMNA (0.75) EGFRRAB9ANR2F2GALR3SMN1; SMN2
SCHEMBL29898477 0.77 LMNA (0.75) EGFRRAB9ANR2F2GALR3SMN1; SMN2
SCHEMBL29386010 0.77 EGFR (1.00) EGFRRAB9ANR2F2GALR3SMN1; SMN2
SCHEMBL7612718 0.77 EGFR (1.00) EGFRRAB9ANR2F2GALR3SMN1; SMN2
SCHEMBL29898476 0.77 LMNA (0.75) EGFRRAB9ANR2F2GALR3SMN1; SMN2
SCHEMBL10061697 0.76 SMN1; SMN2 (0.67) EGFRRAB9ANR2F2GALR3SMN1; SMN2
SCHEMBL8498702 0.76 SMN1; SMN2 (0.60) EGFRRAB9ANR2F2GALR3SMN1; SMN2

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 EGFR 833/4885RAB9A 923/4885NR2F2 1040/4885
US-20040142958-A1 Combination therapy for the treatment of pain OPRK1, OPRL1, OPRM1 EGFR 3060/4885RAB9A 4200/4885NR2F2 1157/4885
US-20040156869-A1 2-substituted quinazolin-4-ylamine analogues PIGS, HRH4, GPR88 EGFR 839/4885RAB9A 1012/4885NR2F2 834/4885
US-20060173003-A1 Substituted quinazolin-4-ylamine analogues PIGS, HRH4, GPR88 EGFR 833/4885RAB9A 923/4885NR2F2 1040/4885
US-20040106616-A1 Substituted quinazolin-4-ylamine analogues PIGS, HRH4, GPR88 EGFR 776/4885RAB9A 938/4885NR2F2 977/4885

“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.