SCHEMBL17005885

SCHEMBL17005885

COC(=O)N1CCN(Cc2ccn(Cc3ccc(Cl)c(Cl)c3)c(=O)c2O)CC1

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ VEGFA P15692 6/20 0.65
▸ EGLN1 Q9GZT9 6/20 0.65
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ FAAH O00519 1/20 0.45
▸ OPRK1 P41145 5/20 0.43
▸ OPRM1 P35372 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ OPRD1 P41143 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ CCR3 P51677 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MCHR1 Q99705 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
SCHEMBL17005859 0.91 VEGFA (0.64) VEGFAEGLN1SMN1; SMN2MAPTFAAH
SCHEMBL1770487 0.90 VEGFA (0.79) VEGFAEGLN1MAPTFAAHALDH1A1
SCHEMBL28568963 0.89 VEGFA (0.82) VEGFAEGLN1SMN1; SMN2FAAHALDH1A1
SCHEMBL17005846 0.88 VEGFA (0.67) VEGFAEGLN1SMN1; SMN2MAPTFAAH
SCHEMBL17005945 0.88 VEGFA (0.62) VEGFAEGLN1FAAHCYP2D6ALDH1A1
SCHEMBL17005966 0.88 VEGFA (0.67) VEGFAEGLN1SMN1; SMN2MAPTFAAH
SCHEMBL17005906 0.88 VEGFA (0.62) VEGFAEGLN1SMN1; SMN2MAPTFAAH
SCHEMBL1770053 0.87 EGLN1 (0.64) VEGFAEGLN1SMN1; SMN2MAPTFAAH
SCHEMBL1770477 0.87 VEGFA (0.66) VEGFAEGLN1MAPTALDH1A1KDM4E
SCHEMBL17005895 0.87 VEGFA (0.66) VEGFAEGLN1FAAHCYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106232120-B Process for preparing N-benzyl-3-hydroxy-4-substituted-pyridin-2- (1H) -ones 爱尔皮奥治疗有限公司 2021-01-08 — — CN disclosed
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 102/4885SMN1; SMN2 1117/4885

“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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