SCHEMBL6141592

SCHEMBL6141592

CCOC(=O)C(C=O)c1ccncc1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.42
CDC7 O00311 5/20 0.39
DBF4 Q9UBU7 5/20 0.39
MAPT P10636 3/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 4/20 0.38
HPGD P15428 1/20 0.38
HSD17B10 Q99714 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
KDM4E B2RXH2 1/20 0.37
CYP19A1 P11511 1/20 0.37
MEN1 O00255 1/20 0.37
CASP1 P29466 1/20 0.37
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL1970294 0.83 MEN1 (0.44) MAPTKMT2ANPSR1ALDH1A1HPGD
SCHEMBL1516027 0.83 MMP8 (0.53) MAPTKMT2AKDM4EMEN1LMNA
SCHEMBL2695334 0.81 GAA (0.46) MAPTKMT2ANPSR1ALDH1A1HPGD
SCHEMBL11770256 0.81 ESR1 (0.49) MAPTKMT2AALDH1A1KDM4ELMNA
SCHEMBL27971666 0.80 MAPT (0.47) MAPTPOLBPKMKMT2ANPSR1
SCHEMBL2554850 0.80 MAPT (0.47) MAPTKMT2ANPSR1ALDH1A1HPGD
SCHEMBL3232287 0.80 CA12 (0.45) MAPTPOLBNPSR1ALDH1A1HPGD
SCHEMBL6154370 0.79 MMP8 (0.51) NAMPTCDC7DBF4MAPTPOLB
SCHEMBL6669586 0.79 ALOX15 (0.47) MAPTPOLBKMT2ANPSR1ALDH1A1
SCHEMBL1970366 0.79 MEN1 (0.46) POLBKMT2AALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050222172-A1 Heteroaryl substituted 2-pyridinyl and 2-pyrimidinyl-6,7,8,9-tetrahydropyrimido[1,2-a]pyrimidin-4-one derivatives SANOFI (FR) 2005-10-06 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-20050222172-A1 Heteroaryl substituted 2-pyridinyl and 2-pyrimidinyl-6,7,8,9-tetrahydropyrimido[1,2-a]pyrimidin-4-one derivatives GSK3A, GSK3B, CDK5 NAMPT 1851/4885CDC7 703/4885DBF4 4706/4885

“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.