SCHEMBL17005930

SCHEMBL17005930

COc1cccc(OC)c1Cn1ccc(CN2CCN(C(=O)O)CC2)c(O)c1=O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ VEGFA P15692 5/20 0.55
▸ EGLN1 Q9GZT9 5/20 0.55
▸ KDM4E B2RXH2 7/20 0.46
▸ ALOX15 P16050 2/20 0.46
▸ ALDH1A1 P00352 6/20 0.45
▸ HTT P42858 3/20 0.45
▸ LMNA P02545 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ FAAH O00519 1/20 0.44
▸ MEN1 O00255 3/20 0.42
▸ KMT2A Q03164 3/20 0.42
▸ TP53 P04637 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ MAPK1 P28482 1/20 0.42

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
SCHEMBL17005886 0.91 VEGFA (0.54) VEGFAEGLN1KDM4EALOX15ALDH1A1
SCHEMBL17005932 0.89 VEGFA (0.58) VEGFAEGLN1KDM4EALOX15ALDH1A1
SCHEMBL17005965 0.89 ALDH1A1 (0.52) VEGFAEGLN1KDM4EALOX15ALDH1A1
SCHEMBL17005961 0.89 KDM4E (0.54) VEGFAEGLN1KDM4EALOX15ALDH1A1
SCHEMBL28914255 0.87 VEGFA (0.68) VEGFAEGLN1KDM4EALOX15ALDH1A1
SCHEMBL17005940 0.86 VEGFA (0.58) VEGFAEGLN1KDM4EALDH1A1HTT
SCHEMBL17005917 0.85 VEGFA (0.60) VEGFAEGLN1KDM4EALDH1A1LMNA
SCHEMBL17005984 0.84 VEGFA (0.61) VEGFAEGLN1KDM4EALDH1A1HTT
SCHEMBL17005915 0.84 VEGFA (0.58) VEGFAEGLN1KDM4EALDH1A1LMNA
SCHEMBL17005976 0.84 VEGFA (0.58) VEGFAEGLN1KDM4EALOX15ALDH1A1

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
EP-3107542-B1 PROCESS FOR PREPARING N-BENZYL-3-HYDROXY-4-SUBSTITUTED-PYRIDIN-2-(1H)-ONES AERPIO THERAPEUTICS INC (US) 2019-05-01 — — EP disclosed
EP-3107542-A1 PROCESS FOR PREPARING N-BENZYL-3-HYDROXY-4-SUBSTITUTED-PYRIDIN-2-(1H)-ONES Aerpio Therapeutics, Inc. (US) 2016-12-28 — — EP disclosed
US-9388135-B2 Process for preparing N-benzyl-3-hydroxy-4-substituted-pyridin-2-(1H)-ones AERPIO THERAPEUTICS, INC. (US) 2016-07-12 — — US disclosed
WO-2015126860-A1 PROCESS FOR PREPARING N-BENZYL-3-HYDROXY-4-SUBSTITUTED-PYRIDIN-2-(1H)-ONES AERPIO THERAPEUTICS, INC. (US) 2015-08-27 — — WO disclosed
US-20150232425-A1 PROCESS FOR PREPARING N-BENZYL-3-HYDROXY-4-SUBSTITUTED-PYRIDIN-2-(1H)-ONES AERPIO THERAPEUTICS, INC. 2015-08-20 — — 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 (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-20150232425-A1 PROCESS FOR PREPARING N-BENZYL-3-HYDROXY-4-SUBSTITUTED-PYRIDIN-2-(1H)-ONES CYP4B1, CYP8B1, HPD VEGFA 4681/4885EGLN1 102/4885KDM4E 195/4885

“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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