SCHEMBL4336958

SCHEMBL4336958

Cc1cc(C)c(OC[C@@H](O)COc2cccc(C[C@H](OC(C)C)C(=O)O)c2)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.41
PPARA Q07869 12/20 0.41
PPARD Q03181 4/20 0.41
POLB P06746 1/20 0.40
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
GLA P06280 1/20 0.37
MAPT P10636 1/20 0.37
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
ABCB1 P08183 1/20 0.37

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
SCHEMBL4336785 1.00 PPARG (0.41) PPARGPPARAPPARDPOLBADRB2
SCHEMBL4336791 1.00 PPARG (0.41) PPARGPPARAPPARDPOLBADRB2
SCHEMBL4341681 0.89 ADRB2 (0.50) PPARGPPARAPPARDADRB2ADRB1
SCHEMBL4334574 0.88 PPARG (0.48) PPARGPPARAPPARDADRB2ADRB1
SCHEMBL4334569 0.88 PPARG (0.48) PPARGPPARAPPARDADRB2ADRB1
SCHEMBL4334564 0.88 PPARG (0.48) PPARGPPARAPPARDADRB2ADRB1
SCHEMBL4329835 0.88 MRGPRX4 (0.43) PPARGPPARAPPARDADRB2ADRB1
SCHEMBL4329829 0.88 MRGPRX4 (0.43) PPARGPPARAPPARDADRB2ADRB1
SCHEMBL4333246 0.88 MRGPRX4 (0.43) PPARGPPARAPPARDADRB2ADRB1
SCHEMBL4332358 0.87 SMN1; SMN2 (0.44) PPARGPPARAPPARD

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 PPARG 379/4885PPARA 339/4885PPARD 753/4885

“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.