SCHEMBL4335047

SCHEMBL4335047

CC(C)OC(Cc1cn(C)c2ccc(OCC(O)COc3ccc(F)c(Cl)c3)cc12)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 1/20 0.38
ICMT O60725 2/20 0.35
MTNR1A P48039 4/20 0.35
MTNR1B P49286 4/20 0.35
MCL1 Q07820 1/20 0.35
PPARG P37231 2/20 0.35
PPARA Q07869 1/20 0.35
NQO2 P16083 1/20 0.35
ADA P00813 1/20 0.34
ADRB2 P07550 1/20 0.34
ATF4 P18848 3/20 0.34
HIF1A Q16665 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL4341174 0.92 PPARG (0.38) PLA2G4AMTNR1AMTNR1BMCL1PPARG
SCHEMBL4329911 0.91 PLA2G4A (0.44) PLA2G4AMTNR1AMTNR1BMCL1PPARG
SCHEMBL13819541 0.90 PLA2G4A (0.36) PLA2G4AMTNR1AMTNR1BMCL1NQO2
SCHEMBL4342749 0.89 PLA2G4A (0.42) PLA2G4AMTNR1AMTNR1BMCL1PPARG
SCHEMBL4337058 0.88 PLA2G4A (0.41) PLA2G4AMTNR1AMTNR1BMCL1PPARG
SCHEMBL4343659 0.88 PLA2G4A (0.41) PLA2G4APPARGPPARAADA
SCHEMBL4339112 0.87 MRGPRX4 (0.36) PLA2G4AMTNR1AMTNR1BMCL1NQO2
SCHEMBL4331747 0.84 PPARG (0.42) PLA2G4AMTNR1AMTNR1BMCL1PPARG
SCHEMBL4328073 0.83 PLA2G4A (0.38) PLA2G4AADA
SCHEMBL4341738 0.82 KMT2A (0.39) MTNR1AMTNR1BPPARGPPARAADA

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100522944-C Carboxylic acid derivatives and salts thereof EISAI CO LTD (JP) 2009-08-05 CN 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-7544835-B2 Carboxylic acid derivative and salt thereof EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-09 US disclosed
CN-1503774-A Carboxylic acid derivatives and salts thereof ������������ʽ���� 2004-06-09 CN 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 PLA2G4A 3556/4885ICMT 4219/4885MTNR1A 42/4885

“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.