SCHEMBL29328606

SCHEMBL29328606

O=C(CCOCCOCCON1C(=O)c2ccccc2C1=O)ON1C(=O)CCC1=O

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.61
ALDH1A1 P00352 5/20 0.55
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 1/20 0.42
ALOX12 P18054 1/20 0.39
RECQL P46063 1/20 0.39
MAPK1 P28482 1/20 0.36
MEN1 O00255 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
PSMB8 P28062 1/20 0.36
PSMB5 P28074 1/20 0.36

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
SCHEMBL29475719 1.00 GAA (0.61) GAAALDH1A1CYP1A2CYP2C9ALOX12
SCHEMBL14237953 1.00 GAA (0.61) GAAALDH1A1CYP1A2CYP2C9ALOX12
SCHEMBL14237937 1.00 GAA (0.61) GAAALDH1A1CYP1A2CYP2C9ALOX12
SCHEMBL29034567 0.85 GAA (0.47) GAAALDH1A1CYP1A2CYP2C9ALOX12
SCHEMBL14237747 0.85 ALOX12 (0.48) GAAALDH1A1CYP1A2CYP2C9ALOX12
SCHEMBL23921486 0.83 GAA (0.52) GAAALDH1A1CYP1A2CYP2C9RECQL
SCHEMBL10086616 0.82 PSMB8 (0.32) ALOX12PSMB8PSMB5
SCHEMBL17776322 0.82 PSMB8 (0.32) ALOX12PSMB8PSMB5
SCHEMBL18751700 0.82 PSMB8 (0.32) ALOX12PSMB8PSMB5
SCHEMBL13635161 0.82 PSMB8 (0.32) ALOX12PSMB8PSMB5

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-20240239889-A1 ANTI-CD3-FOLATE CONJUGATES AND THEIR USES AMBRX, INC. (US) 2024-07-18 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-20240239889-A1 ANTI-CD3-FOLATE CONJUGATES AND THEIR USES FOLR1, FOLR2, FCGR1A GAA 497/4885ALDH1A1 1801/4885CYP1A2 3795/4885

“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.