SCHEMBL7053931

SCHEMBL7053931

CCC(CCCCCC/C=C/CCCCCCO)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.53
MAPK1 P28482 1/20 0.53
FFAR1 O14842 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
CHRM1 P11229 2/20 0.41
AKR1A1 P14550 1/20 0.41
CHRM3 P20309 1/20 0.41
HTR2A P28223 1/20 0.41
HTR2C P28335 1/20 0.41
ADRA1A P35348 1/20 0.41
HRH1 P35367 1/20 0.41
DRD3 P35462 1/20 0.41
SLC6A3 Q01959 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TERT O14746 3/20 0.41
PTPN1 P18031 3/20 0.41
MAPT P10636 2/20 0.41
BLM P54132 2/20 0.41

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
SCHEMBL7053939 1.00 CA2 (0.53) CA2MAPK1FFAR1FFAR4CHRM1
Oleyl Alcohol SCHEMBL8664395 0.92 CA2 (0.62) CA2MAPK1CHRM1TDP1TERT
Oleyl Alcohol SCHEMBL8664398 0.92 CA2 (0.62) CA2MAPK1CHRM1TDP1TERT
SCHEMBL29665607 0.89 CA2 (0.65) CA2MAPK1FFAR1CHRM1AKR1A1
SCHEMBL6097748 0.89 CA2 (0.65) CA2MAPK1FFAR1CHRM1AKR1A1
SCHEMBL7583937 0.89 CA2 (0.65) CA2MAPK1FFAR1CHRM1AKR1A1
SCHEMBL9633629 0.89 CA2 (0.65) CA2MAPK1FFAR1CHRM1AKR1A1
SCHEMBL3686551 0.89 CA2 (0.65) CA2MAPK1FFAR1CHRM1AKR1A1
SCHEMBL5712802 0.89 CA2 (0.65) CA2MAPK1FFAR1CHRM1AKR1A1
SCHEMBL11354682 0.88 TERT (0.51) FFAR1FFAR4CHRM1TDP1TERT

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-6639089-B2 Therapy, side effect reduction SODA AROMATIC CO., LTD. 2003-10-28 US disclosed
US-20030055105-A1 Anticancer agents, perfumes or foods and drinks containing omega-hydroxyfatty acids SODA AROMATIC CO., LTD. A JAPANESE CORPORATION (JP) 2003-03-20 US disclosed
EP-1249236-A1 ANTICANCER AGENTS, PERFUMES OR FOODS AND DRINKS CONTAINING $g(v)-HYDROXYFATTY ACIDS SODA AROMATIC COMPANY, LIMITED (JP) 2002-10-16 EP 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-20030055105-A1 Anticancer agents, perfumes or foods and drinks containing omega-hydroxyfatty acids ALOX5, ELOVL5, ELOVL3 CA2 1961/4885MAPK1 2632/4885FFAR1 88/4885

“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.