SCHEMBL14299528

SCHEMBL14299528

CC(=O)C(O)c1c[nH]c(=O)nc1NCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 2/20 0.46
▸ ACHE P22303 2/20 0.43
▸ USP2 O75604 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ LMNA P02545 1/20 0.41
▸ RAD52 P43351 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ PPARG P37231 1/20 0.39
▸ ELANE P08246 1/20 0.39
▸ KDM5B Q9UGL1 1/20 0.39
▸ RECQL P46063 1/20 0.38

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
SCHEMBL28526402 0.76 APP (0.55) APPUSP2ALDH1A1ALOX15MAPK1
SCHEMBL14299169 0.74 ALDH1A1 (0.47) APPACHEUSP2ALDH1A1ALOX15
SCHEMBL2463445 0.73 APP (0.56) APPACHEALDH1A1LMNARAD52
SCHEMBL10580470 0.65 BACE1 (0.51) APPELANE
SCHEMBL12322087 0.63 APP (1.00) APPACHEALDH1A1LMNARAD52
SCHEMBL16796074 0.63 CDK1 (0.51) APPACHEATM
SCHEMBL248683 0.63 ELANE (0.50) APPALDH1A1LMNAELANERECQL
SCHEMBL28426901 0.62 KDM5B (0.57) ALDH1A1SMN1; SMN2PPARGKDM5B
Acetic Acid SCHEMBL27637376 0.62 GAA (0.66) APPACHEALDH1A1LMNAHTT
N-Benzylaniline SCHEMBL9853072 0.61 CA1 (0.64) ALDH1A1ALOX15MAPK1HTTPPARG

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-20120322755-A1 CYTOSINE ANALOGUE, A METHOD OF PREPARATION OF A CYTOSINE ANALOGUE, A DNA METHYLTRANSFERASE 1 INHIBITOR, A METHOD FOR DNA METHYLATION INHIBITION, THE USE OF THE ANALOGUE IN THE TREATMENT OF DISEASES ASSOCIATED WITH DEVIATIONS FROM NORMAL DNA METHYLATION INSTYTUT CHEMII BIOORGANICZNEJ PAN (PL) 2012-12-20 — — 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-20120322755-A1 CYTOSINE ANALOGUE, A METHOD OF PREPARATION OF A CYTOSINE ANALOGUE, A DNA METHYLTRANSFERASE 1 INHIBITOR, A METHOD FOR DNA METHYLATION INHIBITION, THE USE OF THE ANALOGUE IN THE TREATMENT OF DISEASES ASSOCIATED WITH DEVIATIONS FROM NORMAL DNA METHYLATION DNMT1, DIMT1, TPMT APP 3910/4885ACHE 1788/4885USP2 2902/4885

“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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