SCHEMBL271701

SCHEMBL271701

COc1cccc(Cn2ccc(CN3CCCC3)c(O)c2=O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VEGFA P15692 5/20 0.60
EGLN1 Q9GZT9 5/20 0.60
MAPT P10636 2/20 0.55
LMNA P02545 1/20 0.55
TP53 P04637 1/20 0.55
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
SIGMAR1 Q99720 1/20 0.50
ATM Q13315 1/20 0.50
HRH3 Q9Y5N1 1/20 0.49
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
LPO P22079 1/20 0.47
MAPK1 P28482 1/20 0.47
CASP1 P29466 1/20 0.47
HSD17B10 Q99714 1/20 0.47
PTGER3 P43115 1/20 0.47
HDAC3 O15379 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46

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
SCHEMBL1772095 0.99 VEGFA (0.59) VEGFAEGLN1MAPTLMNATP53
SCHEMBL30402716 0.99 VEGFA (0.59) VEGFAEGLN1MAPTLMNATP53
SCHEMBL272197 0.91 VEGFA (0.61) VEGFAEGLN1MAPTLMNATP53
SCHEMBL17005917 0.89 VEGFA (0.60) VEGFAEGLN1MAPTLMNATP53
SCHEMBL272504 0.88 VEGFA (0.62) VEGFAEGLN1MAPTLMNATP53
SCHEMBL17005979 0.88 VEGFA (0.56) VEGFAEGLN1MAPTLMNATP53
SCHEMBL17005952 0.86 VEGFA (0.55) VEGFAEGLN1MAPTLMNATP53
SCHEMBL28572828 0.84 VEGFA (0.70) VEGFAEGLN1MAPTLMNATP53
SCHEMBL2682460 0.82 VEGFA (0.77) VEGFAEGLN1MAPTLMNATP53
SCHEMBL273037 0.82 EGLN1 (0.87) VEGFAEGLN1LMNATP53MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1558579-B1 N-ALKYL-4-METHYLENEAMINO-3-HYDROXY-2-PYRIDONES AS ANTIMICROBIALS PROCTER & GAMBLE (US) 2007-09-12 EP claimed
US-7247648-B2 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY (US) 2007-07-24 US claimed
US-20050234045-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY (US) 2005-10-20 US claimed
US-6930117-B2 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY (US) 2005-08-16 US claimed
US-20040097560-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY 2004-05-20 US claimed
US-20120115876-A1 N-BENZYL-4-METHYLENEAMINO-3-HYDROXY-2-PYRIDONES WARSHAKOON NAMAL CHITHRANGA (US) 2012-05-10 US disclosed
US-8133894-B2 N-benzyl-4-methyleneamino-3-hydroxy-2-pyridones AKEBIA THERAPEUTICS INC. (US) 2012-03-13 US disclosed
US-20070270407-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY 2007-11-22 US disclosed
US-7247648-B2 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY (US) 2007-07-24 US disclosed
US-20050234045-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY (US) 2005-10-20 US disclosed
US-6930117-B2 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY (US) 2005-08-16 US disclosed
US-20040097560-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones THE PROCTER & GAMBLE COMPANY 2004-05-20 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 (4 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-20120115876-A1 N-BENZYL-4-METHYLENEAMINO-3-HYDROXY-2-PYRIDONES IL17A, IFNG, CD4 VEGFA 3152/4885EGLN1 776/4885MAPT 2513/4885
US-20040097560-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones IL17A, CYP51A1, CD4 VEGFA 3112/4885EGLN1 926/4885MAPT 2747/4885
US-20070270407-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones IL17A, IFNG, CD4 VEGFA 2758/4885EGLN1 1060/4885MAPT 2358/4885
US-20050234045-A1 N-alkyl-4-methyleneamino-3-hydroxy-2-pyridones IL17A, IFNG, CD4 VEGFA 3064/4885EGLN1 1182/4885MAPT 2417/4885

“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.