SCHEMBL4333358

SCHEMBL4333358

CCOC(=O)C(Cc1ccc(CBr)cc1)OC(C)C

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.41
CYP4A11 Q02928 1/20 0.41
MMP8 P22894 1/20 0.38
PPARA Q07869 8/20 0.38
CPB2 Q96IY4 1/20 0.36
PPARG P37231 7/20 0.35
PPARD Q03181 4/20 0.35
EPHX2 P34913 4/20 0.35
MME P08473 1/20 0.35
ACE P12821 1/20 0.35
ADRB2 P07550 2/20 0.34
ADRB1 P08588 2/20 0.34
ADRB3 P13945 2/20 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
SCHEMBL4339990 0.86 PPARA (0.43) CYP4F2CYP4A11MMP8PPARAPPARG
SCHEMBL5384008 0.86 ESR1 (0.45) PPARA
SCHEMBL3991226 0.86 ESR1 (0.45) PPARA
SCHEMBL13819361 0.86 CYP4F2 (0.41) CYP4F2CYP4A11MMP8PPARAPPARG
SCHEMBL1857286 0.85 LMNA (0.46) MMP8PPARACPB2PPARGPPARD
SCHEMBL28751620 0.85 LOXL2 (0.39) MMP8PPARACPB2PPARGPPARD
SCHEMBL4333135 0.84 CYP4F2 (0.53) CYP4F2CYP4A11MMP8PPARAPPARG
Hydrochloric Acid SCHEMBL4329895 0.84 LOXL2 (0.38) MMP8PPARACPB2
SCHEMBL6497419 0.82 CYP19A1 (0.42) MMP8
SCHEMBL6506184 0.82 ALOX15 (0.46) PPARAPPARGPPARD

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 3 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-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 CYP4F2 792/4885CYP4A11 188/4885MMP8 2034/4885

“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.