SCHEMBL2234794

SCHEMBL2234794

COC(=O)c1ncn(C)c1N

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ ALDH1A1 P00352 5/20 0.39
▸ LMNA P02545 1/20 0.39
▸ GAA P10253 2/20 0.38
▸ APOBEC3A P31941 1/20 0.38
▸ APOBEC3G Q9HC16 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ HPGD P15428 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ TSHR P16473 1/20 0.36
▸ CFTR P13569 1/20 0.35
▸ GLA P06280 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
SCHEMBL1990691 0.81 ALDH1A1 (0.46) SMN1; SMN2CYP1A2ALDH1A1LMNAGAA
SCHEMBL13651660 0.79 NPSR1 (0.45) NPSR1TP53SMN1; SMN2ALDH1A1LMNA
SCHEMBL12255736 0.79 NPSR1 (0.45) NPSR1SMN1; SMN2ALDH1A1GAAAPOBEC3A
SCHEMBL71364 0.79 APOBEC3A (0.46) NPSR1ALDH1A1LMNAAPOBEC3AAPOBEC3G
SCHEMBL13688644 0.79 ALDH1A1 (0.42) ALDH1A1LMNAAPOBEC3AAPOBEC3G
SCHEMBL5433650 0.79 LMNA (0.42) ALDH1A1LMNAGAAAPOBEC3AAPOBEC3G
SCHEMBL2112227 0.79 ALDH1A1 (0.59) TP53ALDH1A1LMNAAPOBEC3AAPOBEC3G
SCHEMBL31336864 0.78 NPSR1 (0.43) NPSR1TP53ALDH1A1APOBEC3AAPOBEC3G
SCHEMBL31336866 0.78 KDM4E (0.44) NPSR1SMN1; SMN2ALDH1A1APOBEC3AAPOBEC3G
SCHEMBL31336867 0.78 KDM4E (0.44) NPSR1SMN1; SMN2ALDH1A1APOBEC3AAPOBEC3G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759361-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2014-06-24 — — US disclosed
EP-2061794-B1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORP (US) 2012-12-05 — — EP disclosed
US-20120208829-A1 2-PHENOXY PYRIMIDINONE ANALOGUES NEUROGEN CORPORATION (US) 2012-08-16 — — US disclosed
US-8003656-B2 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2011-08-23 — — US disclosed
US-20090069347-A1 2-phenoxy pyrimidinone analogues NEUROGEN CORPORATION (US) 2009-03-12 — — 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 (2 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-20120208829-A1 2-PHENOXY PYRIMIDINONE ANALOGUES GPR174, GPR17, PTGFR NPSR1 219/4885TP53 2897/4885SMN1; SMN2 1895/4885
US-20090069347-A1 2-phenoxy pyrimidinone analogues GPR174, GPR17, PTGFR NPSR1 219/4885TP53 2897/4885SMN1; SMN2 1895/4885

“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.

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