SCHEMBL4340238

SCHEMBL4340238

CC(=O)c1ccc(OC[C@H](O)COc2cccc(C[C@H](OC(C)C)C(=O)O)c2)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 5/20 0.42
ATM Q13315 1/20 0.41
POLB P06746 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PPARG P37231 2/20 0.41
PPARA Q07869 2/20 0.41
MAOB P27338 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39

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
SCHEMBL4340232 1.00 ABCB1 (0.42) ABCB1ATMPOLBLMNAMAPT
SCHEMBL4336887 0.90 SCN4A (0.47) POLBLMNAMAPTPPARGPPARA
SCHEMBL4333309 0.90 SCN4A (0.47) POLBLMNAMAPTPPARGPPARA
SCHEMBL4333304 0.90 SCN4A (0.47) POLBLMNAMAPTPPARGPPARA
SCHEMBL4329835 0.89 MRGPRX4 (0.43) ABCB1PPARGPPARAMEN1KMT2A
SCHEMBL4329829 0.89 MRGPRX4 (0.43) ABCB1PPARGPPARAMEN1KMT2A
SCHEMBL4333246 0.89 MRGPRX4 (0.43) ABCB1PPARGPPARAMEN1KMT2A
SCHEMBL4340105 0.88 MRGPRX4 (0.45) PPARGPPARA
SCHEMBL4340107 0.88 MRGPRX4 (0.45) PPARGPPARA
SCHEMBL4346027 0.88 MRGPRX4 (0.45) PPARGPPARA

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 ABCB1 1623/4885ATM 3249/4885POLB 3622/4885

“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.