SCHEMBL4341964

SCHEMBL4341964

COc1ccc(CC(OC(C)C)C(=O)O)cc1OCCOc1ccc(Cl)cc1Cl

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 2/20 0.50
PPARA Q07869 7/20 0.49
MRGPRX4 Q96LA9 2/20 0.49
PPARG P37231 5/20 0.48
PPARD Q03181 3/20 0.48
LDHA P00338 1/20 0.47
HPGD P15428 2/20 0.47
MAPT P10636 2/20 0.46
NLRP1 Q9C000 1/20 0.45
LMNA P02545 1/20 0.43
S1PR4 O95977 1/20 0.43
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL13819358 0.88 HDAC8 (0.54) MMP1PPARAMRGPRX4PPARGPPARD
SCHEMBL13819356 0.86 MMP1 (0.55) MMP1PPARAMRGPRX4PPARGPPARD
SCHEMBL4336847 0.84 PPARA (0.54) PPARAMRGPRX4PPARGPPARDHPGD
SCHEMBL4332249 0.83 MMP1 (0.45) MMP1PPARAMRGPRX4PPARGPPARD
SCHEMBL5551004 0.83 PPARA (0.47) PPARAPPARGPPARDHPGDMAPT
SCHEMBL4346276 0.83 PPARA (0.55) MMP1PPARAPPARGPPARDLDHA
SCHEMBL4337189 0.82 MAPT (0.52) MAPTLMNATDP1
SCHEMBL4339301 0.82 PPARA (0.54) PPARAMRGPRX4PPARGPPARDHPGD
SCHEMBL13819371 0.82 MMP1 (0.48) MMP1PPARAMRGPRX4PPARGPPARD
SCHEMBL4341219 0.81 PPARA (0.53) PPARAMRGPRX4PPARGPPARDHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
US-20040102634-A1 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-05-27 US disclosed
EP-1380562-A1 CARBOXYLIC ACID DERIVATIVE AND SALT THEREOF Eisai Co., Ltd. (JP) 2004-01-14 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-20040102634-A1 Carboxylic acid derivative and salt thereof GPR119, IRS1, SLC5A1 MMP1 1890/4885PPARA 339/4885MRGPRX4 428/4885

“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.