SCHEMBL25901508

SCHEMBL25901508

C[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)OCc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.65
LAP3 P28838 1/20 0.65
MAOB P27338 2/20 0.60
PPARA Q07869 4/20 0.58
PPARG P37231 3/20 0.58
FFAR1 O14842 2/20 0.57
FFAR4 Q5NUL3 1/20 0.57
LMNA P02545 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
PPARD Q03181 1/20 0.55
NR4A1 P22736 1/20 0.54
NR4A2 P43354 1/20 0.54
NR4A3 Q92570 1/20 0.54
ALOX5 P09917 3/20 0.54
PTGS1 P23219 1/20 0.52
PTGS2 P35354 1/20 0.52

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
SCHEMBL27977003 0.90 LTA4H (0.68) LTA4HLAP3MAOBPPARAPPARG
SCHEMBL21366441 0.90 LTA4H (0.68) LTA4HLAP3MAOBPPARAPPARG
SCHEMBL12764099 0.89 ALDH1A1 (0.58) LTA4HLAP3L3MBTL1
SCHEMBL265561 0.89 ALDH1A1 (0.58) LTA4HLAP3L3MBTL1
SCHEMBL265176 0.89 ALDH1A1 (0.58) LTA4HLAP3L3MBTL1
SCHEMBL14462588 0.88 L3MBTL1 (0.60) LTA4HLAP3MAOBFFAR1FFAR4
SCHEMBL4665082 0.88 FFAR1 (0.67) LTA4HLAP3MAOBPPARAPPARG
SCHEMBL10071090 0.88 FFAR1 (0.67) LTA4HLAP3MAOBPPARAPPARG
SCHEMBL8268038 0.87 PPARG (0.50) LTA4HLAP3PPARAPPARGLMNA
SCHEMBL14501342 0.87 MAOB (0.61) LTA4HLAP3MAOBPPARAPPARG

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-11713339-B2 Macrocyclization of peptidomimetics UNIVERSITY OF WARWICK (GB) 2023-08-01 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-11713339-B2 Macrocyclization of peptidomimetics NGLY1, MAX, PTMA LTA4H 2810/4885LAP3 278/4885MAOB 2047/4885

“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.