SCHEMBL4530820

SCHEMBL4530820

O=C(O)CCc1ccc(OCCCCOc2ccccc2)cc1

nearest known ligand 0.88

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 13/20 0.88
FFAR4 Q5NUL3 3/20 0.71
LMNA P02545 1/20 0.71
L3MBTL1 Q9Y468 1/20 0.71
S1PR1 P21453 4/20 0.65
S1PR3 Q99500 2/20 0.63
S1PR5 Q9H228 1/20 0.63
SRD5A2 P31213 1/20 0.62
PPARG P37231 1/20 0.62
PPARD Q03181 1/20 0.62
PPARA Q07869 1/20 0.62

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
SCHEMBL1746597 0.93 FFAR1 (1.00) FFAR1FFAR4LMNAL3MBTL1S1PR1
SCHEMBL8213476 0.92 FFAR1 (0.81) FFAR1FFAR4LMNAL3MBTL1SRD5A2
SCHEMBL4656572 0.92 FFAR1 (0.97) FFAR1FFAR4LMNAL3MBTL1S1PR1
SCHEMBL8767174 0.92 FFAR1 (0.79) FFAR1FFAR4LMNAL3MBTL1S1PR1
SCHEMBL1744690 0.92 FFAR1 (1.00) FFAR1FFAR4LMNAL3MBTL1S1PR1
SCHEMBL8767670 0.90 FFAR1 (0.72) FFAR1FFAR4LMNAL3MBTL1S1PR1
SCHEMBL1745370 0.90 FFAR1 (1.00) FFAR1FFAR4LMNAL3MBTL1S1PR1
SCHEMBL24723561 0.87 L3MBTL1 (0.82) FFAR1LMNAL3MBTL1S1PR1S1PR3
SCHEMBL1532487 0.87 FFAR1 (0.72) FFAR1FFAR4LMNAL3MBTL1S1PR1
SCHEMBL4532106 0.87 FFAR1 (0.68) FFAR1FFAR4LMNAL3MBTL1S1PR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7498460-B2 Isophthalic acid derivatives BAYER HEALTHCARE AG (DE) 2009-03-03 US disclosed
US-7498460-B2 Isophthalic acid derivatives BAYER HEALTHCARE AG (DE) 2009-03-03 US disclosed
US-7498460-B2 Isophthalic acid derivatives BAYER HEALTHCARE AG (DE) 2009-03-03 US disclosed
EP-1572628-B1 ISOPHTALIC ACID DERIVATIVES BAYER HEALTHCARE AG (DE) 2007-07-25 EP disclosed
EP-1572628-B1 ISOPHTALIC ACID DERIVATIVES BAYER HEALTHCARE AG (DE) 2007-07-25 EP disclosed
EP-1740540-A1 PHENYL ACETAMIDES Bayer HealthCare AG (DE) 2007-01-10 EP disclosed
US-20060154912-A1 Isophtalic acid derivatives BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2006-07-13 US disclosed
WO-2005103001-A1 PHENYL ACETAMIDES BAYER HEALTHCARE AG (DE) 2005-11-03 WO disclosed
EP-1572628-A1 ISOPHTALIC ACID DERIVATIVES Bayer HealthCare AG (DE) 2005-09-14 EP disclosed
WO-2004052839-A1 ISOPHTALIC ACID DERIVATIVES BAYER HEALTHCARE AG (DE) 2004-06-24 WO disclosed
EP-0791576-A2 Leukotriene antagonistic benzoic acid derivatives BAYER AG (DE) 1997-08-27 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-20060154912-A1 Isophtalic acid derivatives VHL, FABP3, CPT1A FFAR1 832/4885FFAR4 1065/4885LMNA 655/4885

“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.