SCHEMBL29980822

SCHEMBL29980822

CCNC(=O)C(=O)OC1CCCCC1

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.68
NAAA Q02083 2/20 0.45
GPR35 Q9HC97 3/20 0.40
HTT P42858 2/20 0.40
CYP2C19 P33261 1/20 0.39
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP19A1 P11511 1/20 0.35

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
SCHEMBL26670015 0.82 EPHX1 (0.64) EPHX1NAAAHTTCYP2C19ALDH1A1
SCHEMBL30541899 0.82 EPHX1 (0.46) EPHX1NAAAGPR35CYP19A1
SCHEMBL967579 0.81 EPHX1 (1.00) EPHX1NAAAHTTCYP2C19ALDH1A1
SCHEMBL18186686 0.79 EPHX1 (0.53) EPHX1NAAAGPR35HTTCYP2C19
SCHEMBL3927732 0.79 EPHX1 (0.53) EPHX1NAAAGPR35HTTCYP2C19
SCHEMBL965658 0.79 EPHX1 (0.96) EPHX1NAAAHTTCYP2C19ALDH1A1
SCHEMBL6950279 0.76 SMN1; SMN2 (0.58) EPHX1NAAAGPR35CYP2C19ALDH1A1
SCHEMBL3020222 0.76 NAAA (0.54) EPHX1NAAAGPR35HTTCYP2C19
SCHEMBL2999385 0.75 EPHX1 (0.54) EPHX1NAAAGPR35HTTCYP2C19
SCHEMBL15777906 0.75 EPHX1 (0.89) EPHX1NAAAHTTALDH1A1SMN1; SMN2

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-11491091-B2 Cooling product SYMRISE AG (DE) 2022-11-08 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-11491091-B2 Cooling product TRPA1, TRPV2, TRPV1 EPHX1 1461/4885NAAA 341/4885GPR35 3635/4885

“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.