SCHEMBL6577510

SCHEMBL6577510

NN(C(=O)c1cc(Cl)c(OCCCCCC(=O)O)c(Cl)c1)C(=O)c1ccccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 1/20 0.57
▸ PLAU P00749 2/20 0.41
▸ LTB4R Q15722 4/20 0.41
▸ PPARA Q07869 2/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ ABL1 P00519 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ RIN1 Q13671 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ PLA2G2A P14555 1/20 0.37
▸ TTR P02766 1/20 0.37
▸ TP53 P04637 1/20 0.36
▸ SERPINE1 P05121 1/20 0.36
▸ TBXA2R P21731 1/20 0.36

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
SCHEMBL7262401 0.82 PYGL (0.57) PYGLPLAULTB4RPPARATTR
SCHEMBL6577513 0.80 PYGL (0.68) PYGLPLAULTB4RPPARAMEN1
SCHEMBL9780857 0.75 KMT2A (0.61) PYGLLTB4RPPARAALDH1A1MAPT
SCHEMBL9780778 0.73 KMT2A (0.62) PYGLLTB4RPPARAMEN1HPGD
SCHEMBL23752503 0.72 PYGL (1.00) PYGLPLAULTB4RPPARAMEN1
SCHEMBL7262405 0.72 PYGL (1.00) PYGLPLAULTB4RPPARAMEN1
SCHEMBL6575170 0.72 PYGL (0.51) PYGLPLAULTB4RALDH1A1LMNA
Sebacic Acid SCHEMBL448447 0.72 HDAC3 (0.61) PPARAALDH1A1LMNAGAAMAPT
SCHEMBL27815831 0.72 HDAC3 (0.61) PPARAALDH1A1LMNAGAAMAPT
Octanedioate SCHEMBL27794753 0.72 HDAC3 (0.61) PPARAALDH1A1LMNAGAAMAPT

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
EP-1294682-B1 ACYLPHENYL UREA DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF AND USE THEREOF AS A MEDICAMENT AVENTIS PHARMA GMBH (DE) 2004-04-28 — — EP disclosed
EP-1294682-A1 ACYLPHENYL UREA DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF AND USE THEREOF AS A MEDICAMENT Aventis Pharma Deutschland GmbH (DE) 2003-03-26 — — EP disclosed
WO-2001094300-A1 ACYLPHENYL UREA DERIVATIVES, METHODS FOR THE PRODUCTION THEREOF AND USE THEREOF AS A MEDICAMENT AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2001-12-13 — — WO disclosed
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