SCHEMBL13991911

SCHEMBL13991911

CCOC(=O)CCCCNC(=O)C(=O)CC

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.51
▸ EPHX2 P34913 10/20 0.49
▸ CYP1A2 P05177 2/20 0.47
▸ NAMPT P43490 1/20 0.47
▸ PLA2G2A P14555 1/20 0.46
▸ GAA P10253 2/20 0.46
▸ PLA2G4A P47712 1/20 0.42
▸ MGAM O43451 1/20 0.42
▸ SI P14410 1/20 0.42
▸ MGAM2 Q2M2H8 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2C19 P33261 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
SCHEMBL13991878 0.95 CYP1A2 (0.48) ALDH1A1EPHX2CYP1A2GAAPLA2G4A
SCHEMBL13991912 0.87 GAA (0.46) ALDH1A1EPHX2CYP1A2PLA2G2AGAA
SCHEMBL4781039 0.82 PLA2G4A (0.67) ALDH1A1EPHX2PLA2G2AGAAPLA2G4A
SCHEMBL10081657 0.81 ALDH1A1 (0.50) ALDH1A1EPHX2CYP1A2NAMPTGAA
SCHEMBL11789446 0.81 KMT2A (0.61) ALDH1A1EPHX2CYP1A2NAMPTGAA
SCHEMBL13286569 0.80 TSHR (0.52) ALDH1A1EPHX2PLA2G2APLA2G4A
SCHEMBL10080728 0.80 EPHX2 (0.50) ALDH1A1EPHX2CYP1A2NAMPTGAA
SCHEMBL13991913 0.80 EPHX2 (0.49) ALDH1A1EPHX2PLA2G2AGAAPLA2G4A
SCHEMBL11783978 0.79 KDM4E (0.59) ALDH1A1EPHX2CYP1A2NAMPTGAA
SCHEMBL13991921 0.78 TSHR (0.55) ALDH1A1EPHX2CYP1A2PLA2G2AGAA

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-20080319065-A1 Systemic and Intrathecal Effects of a Novel Series of Phospholipase A2 Inhibitors on Hyperalgesia and Spinal Pge2 Release THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2008-12-25 — — 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-20080319065-A1 Systemic and Intrathecal Effects of a Novel Series of Phospholipase A2 Inhibitors on Hyperalgesia and Spinal Pge2 Release PLA2G4A, PLA2G4B, PLA2G2A ALDH1A1 3131/4885EPHX2 140/4885CYP1A2 837/4885

“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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