SCHEMBL4335055

SCHEMBL4335055

CC(C)OC(Cc1cccc(NC(=O)COc2ccc(C(F)(F)F)cc2)c1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.52
PSMB5 P28074 1/20 0.51
LMNA P02545 2/20 0.50
HIF1A Q16665 1/20 0.50
EPAS1 Q99814 1/20 0.50
MAPT P10636 1/20 0.50
HTR2B P41595 1/20 0.49
P2RY14 Q15391 1/20 0.49
PPARG P37231 6/20 0.49
PPARA Q07869 6/20 0.49
PPARD Q03181 3/20 0.49
MDH1 P40925 1/20 0.48
MDH2 P40926 1/20 0.48
MCHR1 Q99705 1/20 0.48
HTT P42858 1/20 0.47
HPGD P15428 1/20 0.46
NPC1 O15118 1/20 0.46
MAPK1 P28482 1/20 0.46

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
SCHEMBL4336619 0.91 HIF1A (0.61) SMN1; SMN2LMNAHIF1AEPAS1MAPT
SCHEMBL4328787 0.88 SMN1; SMN2 (0.57) SMN1; SMN2HIF1AEPAS1MAPTP2RY14
SCHEMBL13819475 0.83 MRGPRX4 (0.59) MAPTPPARGPPARAPPARDHTT
SCHEMBL4336292 0.82 PPARA (0.58) LMNAMAPTPPARGPPARAPPARD
SCHEMBL4338925 0.82 PPARG (0.55) PPARGPPARAPPARD
SCHEMBL4334192 0.82 MGLL (0.60) PPARGPPARAPPARD
SCHEMBL4345878 0.81 PPARA (0.50) PSMB5PPARGPPARAPPARDHPGD
SCHEMBL4346891 0.79 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL6653700 0.78 PPARA (0.48) LMNAPPARGPPARAPPARD
SCHEMBL13819764 0.78 MAOB (0.57) MAPTPPARGPPARAPPARDHTT

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 3054/4885PSMB5 2471/4885LMNA 3790/4885

“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.