SCHEMBL4917285

SCHEMBL4917285

CN(CCON1C(=O)c2ccccc2C1=O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.54
ALDH1A1 P00352 4/20 0.51
CYP1A2 P05177 2/20 0.51
CYP2C9 P11712 1/20 0.51
RECQL P46063 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.43
MAOB P27338 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
POLB P06746 1/20 0.40

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
SCHEMBL9420987 0.83 GAA (0.49) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL4104400 0.82 GAA (0.62) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL31208305 0.82 GAA (0.62) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL4267818 0.82 GAA (0.48) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL16714956 0.81 MEN1 (0.50) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL10601228 0.81 MAOB (0.62) GAAALDH1A1MAOBSMN1; SMN2
SCHEMBL20125239 0.80 GAA (0.59) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL16715045 0.79 GAA (0.51) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL4281261 0.79 GAA (0.48) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL4267823 0.79 GAA (0.48) GAAALDH1A1CYP1A2CYP2C9RECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020138499-A1 ALKYL-SUBSTITUTED COMPOUND 大日本住友製薬株式会社 2020-07-02 WO disclosed
US-20080287477-A1 Novel Compounds as Modulators of Ppar KALYPSYS, INC. (US) 2008-11-20 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-20080287477-A1 Novel Compounds as Modulators of Ppar PPARG, PPARA, PPARD GAA 724/4885ALDH1A1 1419/4885CYP1A2 2682/4885

“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.