SCHEMBL6720362

SCHEMBL6720362

Bc1cccc(CC(OCCC)C(=O)OCC)c1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.40
L3MBTL1 Q9Y468 3/20 0.40
TSHR P16473 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
PPARG P37231 6/20 0.37
PPARA Q07869 5/20 0.37
MMP8 P22894 1/20 0.37
ALDH1A1 P00352 3/20 0.37
TP53 P04637 1/20 0.37
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 1/20 0.35
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL4332256 0.83 MMP8 (0.38) MAPK1L3MBTL1TSHRTDP1PPARG
Hydrochloric Acid SCHEMBL6724404 0.77 PPARA (0.39) PPARGPPARAMMP8
SCHEMBL5379702 0.76 ESR1 (0.45) MAPK1TSHRTDP1PPARGPPARA
SCHEMBL5379694 0.76 ESR1 (0.45) MAPK1TSHRTDP1PPARGPPARA
SCHEMBL6724780 0.76 PPARA (0.42) PPARGPPARAMMP8CYP4F2CYP4A11
SCHEMBL5479352 0.75 PPARG (0.47) PPARGPPARA
SCHEMBL4334124 0.75 PPARG (0.47) PPARGPPARA
SCHEMBL6723554 0.75 CYP4F2 (0.40) PPARGPPARAMMP8CYP4F2CYP4A11
SCHEMBL5479355 0.75 PPARG (0.47) PPARGPPARA
SCHEMBL6731797 0.74 CYP4F2 (0.51) L3MBTL1PPARGPPARAMMP8CYP4F2

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-20040102634-A1 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-05-27 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-20040102634-A1 Carboxylic acid derivative and salt thereof GPR119, IRS1, SLC5A1 MAPK1 698/4885L3MBTL1 3856/4885TSHR 532/4885

“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.