SCHEMBL4332358

SCHEMBL4332358

Cc1ccc(OCC(O)COc2cccc(CC(OC(C)C)C(=O)O)c2)cc1C

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
PPARG P37231 11/20 0.43
PPARA Q07869 11/20 0.43
PPARD Q03181 5/20 0.42
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL4336800 0.91 KMT2A (0.50) SMN1; SMN2PPARGPPARAPPARDMEN1
SCHEMBL13810498 0.91 KMT2A (0.50) SMN1; SMN2PPARGPPARAPPARDMEN1
SCHEMBL4336806 0.91 KMT2A (0.50) SMN1; SMN2PPARGPPARAPPARDMEN1
SCHEMBL4334574 0.90 PPARG (0.48) PPARGPPARAPPARDMEN1KMT2A
SCHEMBL4334564 0.90 PPARG (0.48) PPARGPPARAPPARDMEN1KMT2A
SCHEMBL4334569 0.90 PPARG (0.48) PPARGPPARAPPARDMEN1KMT2A
SCHEMBL4334186 0.90 PPARA (0.48) SMN1; SMN2PPARGPPARAPPARDTDP1
SCHEMBL4341681 0.89 ADRB2 (0.50) SMN1; SMN2PPARGPPARAPPARDMEN1
SCHEMBL4327647 0.88 PPARG (0.44) SMN1; SMN2PPARGPPARAPPARDTDP1
SCHEMBL4341897 0.88 MEN1 (0.42) PPARGPPARAPPARDMEN1KMT2A

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 SMN1; SMN2 3054/4885PPARG 379/4885PPARA 339/4885

“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.