SCHEMBL2536628

SCHEMBL2536628

Cc1ccc(COc2ccc(-c3ccc(OC(F)(F)F)cc3)cc2CCC(=O)O)cc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 9/20 0.53
PTGER4 P35408 3/20 0.53
PTGER3 P43115 2/20 0.53
PTGER1 P34995 1/20 0.53
PTGER2 P43116 1/20 0.53
FFAR4 Q5NUL3 8/20 0.52
PPARD Q03181 3/20 0.52
MMP12 P39900 1/20 0.46
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
RXRG P48443 1/20 0.45

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
SCHEMBL2538764 0.95 FFAR1 (0.55) FFAR1PTGER4PTGER3PTGER1PTGER2
SCHEMBL2532671 0.92 PPARD (0.54) FFAR1PTGER4PTGER3PTGER1PTGER2
SCHEMBL2536454 0.92 FFAR1 (0.52) FFAR1PTGER4PTGER3PTGER1PTGER2
SCHEMBL2532590 0.92 FFAR1 (0.58) FFAR1PTGER4PTGER3PTGER1PTGER2
SCHEMBL2537526 0.92 FFAR1 (0.58) FFAR1PTGER4PTGER3PTGER1PTGER2
SCHEMBL2539633 0.91 FFAR4 (0.52) FFAR1PTGER4PTGER3PTGER1PTGER2
SCHEMBL2534776 0.90 FFAR1 (0.56) FFAR1PTGER4PTGER3PTGER1PTGER2
SCHEMBL2536390 0.90 FFAR4 (0.49) FFAR1PTGER4PTGER3PTGER1PTGER2
SCHEMBL2535066 0.90 FFAR4 (0.49) FFAR1PTGER4PTGER3PTGER1PTGER2
SCHEMBL2533757 0.90 PPARD (0.55) FFAR1FFAR4PPARD

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-8044236-B2 Inhibitors against plasminogen activator inhibitor-1 (PAI-1); anticoagulants; 2-(aryl or aralkyloxy-)-5-(aryl)phenyl}acetic acid (or derivatives of propionic acid, propenoic acid, N-oxamic acid or 1H-tetrazol-5-yl); occlusion, stenosis; low molecular weight; gene expression inhibition INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2011-10-25 US disclosed
EP-2080751-A1 CARBOXYLIC ACID DERIVATIVE Institute of Medicinal Molecular Design, Inc. (JP) 2009-07-22 EP disclosed
US-20080275116-A1 Carboxilic acid derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2008-11-06 US 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-20080275116-A1 Carboxilic acid derivatives SERPINE1, CTRL, SERPINC1 FFAR1 710/4885PTGER4 3046/4885PTGER3 2505/4885

“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.