SCHEMBL3534489

SCHEMBL3534489

CN(C)CC(=O)N1CCC(c2ccc(NC(=O)OC(C)(C)C)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 14/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2C9 P11712 1/20 0.53
PTPN2 P17706 1/20 0.45
PTPN1 P18031 1/20 0.45
PTPN6 P29350 1/20 0.45
CHRM1 P11229 1/20 0.41
MAPT P10636 1/20 0.41
DRD2 P14416 1/20 0.41
TLR9 Q9NR96 1/20 0.41
TLR8 Q9NR97 1/20 0.41
TLR7 Q9NYK1 1/20 0.41

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
SCHEMBL3527537 0.83 NAMPT (0.53) NAMPTCYP3A4CYP2C9DRD2TLR9
SCHEMBL4403152 0.78 LIPE (0.48) NAMPTCYP3A4CYP2C9TLR9TLR8
SCHEMBL27721037 0.77 NAMPT (0.43) NAMPTCYP3A4CYP2C9TLR9TLR8
SCHEMBL8986417 0.77 NAMPT (0.65) NAMPTPTPN2PTPN1PTPN6MAPT
SCHEMBL10156800 0.76 NAMPT (0.60) NAMPTCYP2C9PTPN2PTPN1PTPN6
SCHEMBL13216129 0.76 NAMPT (0.58) NAMPTCYP3A4CYP2C9PTPN2PTPN1
SCHEMBL16994796 0.76 TLR9 (0.51) MAPTDRD2TLR9TLR8TLR7
SCHEMBL22852497 0.75 NAMPT (0.47) NAMPTPTPN2PTPN1PTPN6CHRM1
SCHEMBL612556 0.75 ESR2 (0.47) NAMPTPTPN2PTPN1PTPN6CHRM1
SCHEMBL3006555 0.75 NAMPT (0.52) NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7642270-B2 5-oxo-5,8-dihydro-pyrido-pyrimidine as inhibitors of c-fms kinase JANSSEN PHARMACEUTICA N.V. (BE) 2010-01-05 US disclosed
EP-1937681-A1 5-OXO-5,8-DIHYDRO-PYRIDO-PYRIMIDINES AS INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA N.V. (BE) 2008-07-02 EP disclosed
WO-2007033232-A1 5-OXO-5,8-DIHYDRO-PYRIDO-PYRIMIDINES AS INHIBITORS OF C-FMS KINASE JANSSEN PHARMACEUTICA, N.V. (BE) 2007-03-22 WO disclosed
US-20070060577-A1 5-Oxo-5,8-dihydro-pyrido-pyrimidines as inhibitors of c-fms kinase JANSSEN PHARMACEUTICA N.V. (BE) 2007-03-15 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-20070060577-A1 5-Oxo-5,8-dihydro-pyrido-pyrimidines as inhibitors of c-fms kinase FLT3, FES, FGR NAMPT 2198/4885CYP3A4 3320/4885CYP2C9 1623/4885

“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.