SCHEMBL4348571

SCHEMBL4348571

O=C(O)C(Cc1cccc(CCO)c1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.48
CYP4F2 P78329 2/20 0.47
CYP4A11 Q02928 2/20 0.47
ACMSD Q8TDX5 1/20 0.46
LDHA P00338 2/20 0.45
MDM2 Q00987 1/20 0.43
CYP1A2 P05177 1/20 0.42
SLC7A5 Q01650 2/20 0.42
FOLH1 Q04609 2/20 0.41
KMT2A Q03164 1/20 0.41
SLC1A1 P43005 1/20 0.41
GRIA2 P42262 1/20 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
SCHEMBL4329928 0.85 LDHA (0.47) ACMSDLDHAMDM2CYP1A2SLC7A5
SCHEMBL6746251 0.84 SLC7A5 (0.62) TDP1SLC7A5GRIA2
SCHEMBL4328902 0.82 CYP4F2 (0.56) CYP4F2CYP4A11LDHASLC7A5FOLH1
SCHEMBL239199 0.79 TDP1 (0.65) TDP1CYP4F2CYP4A11ACMSDKMT2A
SCHEMBL11529979 0.79 LDHA (0.46) LDHAMDM2CYP1A2SLC7A5FOLH1
SCHEMBL11153758 0.78 PPARA (0.56)
SCHEMBL3922659 0.77 NPC1 (0.53) TDP1CYP4F2CYP4A11ACMSDKMT2A
SCHEMBL5968748 0.77 AKR1B1 (0.56) TDP1CYP4F2CYP4A11ACMSDCYP1A2
SCHEMBL491093 0.77 GRIA2 (0.58) LDHAMDM2CYP1A2GRIA2
SCHEMBL9338131 0.77 TDP1 (0.46) TDP1CYP4F2CYP4A11ACMSD

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-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 TDP1 4437/4885CYP4F2 792/4885CYP4A11 188/4885

“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.