SCHEMBL23733934

SCHEMBL23733934

O=CCOCCCCCSCCCCCOCC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.38
EPHX2 P34913 1/20 0.35
PLA2G4B P0C869 2/20 0.33
CES2 O00748 2/20 0.33
GMNN O75496 1/20 0.33
TP53 P04637 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
CYP2C9 P11712 1/20 0.33
BLM P54132 1/20 0.33
HSD17B10 Q99714 1/20 0.33
BHMT Q93088 1/20 0.32
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32

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
SCHEMBL23733923 0.88 CYP2C19 (0.42) CYP2C19EPHX2PLA2G4BCES2CYP4F2
SCHEMBL22922026 0.88 CES2 (0.41) CYP2C19EPHX2PLA2G4BCES2GMNN
SCHEMBL22921751 0.86 EPHX2 (0.39) CYP2C19EPHX2PLA2G4BCES2GMNN
SCHEMBL17833869 0.80 PTGS1 (0.36) CYP2C19EPHX2THRBBLMHSD17B10
SCHEMBL29313400 0.79 CES2 (0.43) CYP2C19EPHX2PLA2G4BCES2GMNN
SCHEMBL22771248 0.78 HSD17B10 (0.35) CYP2C19EPHX2TP53THRBBLM
SCHEMBL23733921 0.78 CYP2C19 (0.36) CYP2C19EPHX2CES2CYP4F2CYP4A11
SCHEMBL18660231 0.75 CES2 (0.50) CYP2C19EPHX2PLA2G4BCES2THRB
SCHEMBL7713583 0.75 CES2 (0.50) CYP2C19EPHX2PLA2G4BCES2THRB
SCHEMBL30372910 0.75 CYP2C19 (0.38) CYP2C19EPHX2CES2CYP4F2CYP4A11

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-11084773-B1 Functionalized long-chain hydrocarbon mono- and di-carboxylic acids and their use for the prevention or treatment of disease ESPERVITA THERAPEUTICS, INC. (US) 2021-08-10 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-11084773-B1 Functionalized long-chain hydrocarbon mono- and di-carboxylic acids and their use for the prevention or treatment of disease CPT1A, PPARG, PC CYP2C19 1045/4885EPHX2 1239/4885PLA2G4B 1712/4885

“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.