SCHEMBL20175910

SCHEMBL20175910

COCCOCCOCCOCCOC(C)C

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.34
PIK3CD O00329 1/20 0.31
ALDH1A1 P00352 1/20 0.31
EPHX2 P34913 1/20 0.30

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
SCHEMBL10929539 1.00 CA2 (0.34) CA2PIK3CDALDH1A1EPHX2
SCHEMBL311120 1.00 CA2 (0.34) CA2PIK3CDALDH1A1EPHX2
SCHEMBL811322 1.00 CA2 (0.34) CA2PIK3CDALDH1A1EPHX2
SCHEMBL47033 0.91
SCHEMBL28164439 0.91 PIK3CD (0.35) PIK3CDALDH1A1
SCHEMBL5024988 0.89 MEN1 (0.48) ALDH1A1EPHX2
SCHEMBL987686 0.88 EPHX2 (0.33) ALDH1A1EPHX2
SCHEMBL863208 0.88 EPHX2 (0.33) ALDH1A1EPHX2
SCHEMBL863289 0.88 EPHX2 (0.33) ALDH1A1EPHX2
SCHEMBL987158 0.88 EPHX2 (0.33) ALDH1A1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230382949-A1 LINEAR APELIN RECEPTOR AGONISTS HEPTARES THERAPEUTICS LIMITED (GB) 2023-11-30 US disclosed
WO-2019183523-A1 HETERO-BIFUNCTIONAL DEGRADER COMPOUNDS AND THEIR USE AS MODULATORS OF TARGETED UBIQUINATION (VHL) GENENTECH, INC. (US) 2019-09-26 WO disclosed
US-20180140581-A1 METABOLICALLY PROGRAMMED METAL CHELATORS AND USES THEREOF UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2018-05-24 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 (2 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-20180140581-A1 METABOLICALLY PROGRAMMED METAL CHELATORS AND USES THEREOF FECH, SLC19A1, SLC40A1 CA2 1579/4885PIK3CD 4095/4885ALDH1A1 181/4885
US-20230382949-A1 LINEAR APELIN RECEPTOR AGONISTS APLNR, MTNR1A, EDNRA CA2 3534/4885PIK3CD 4383/4885ALDH1A1 2876/4885

“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.