SCHEMBL6579229

SCHEMBL6579229

COC(=O)C(Cc1ccccc1)ON(C)c1ccc2ccccc2c1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.50
PPARA Q07869 4/20 0.50
PPARD Q03181 2/20 0.47
PTPN1 P18031 1/20 0.42
MAOB P27338 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC1 Q13547 2/20 0.40
HDAC6 Q9UBN7 2/20 0.40
RECQL P46063 1/20 0.39
UTS2R Q9UKP6 1/20 0.39
ABCB1 P08183 1/20 0.39
ACHE P22303 1/20 0.39
ATM Q13315 1/20 0.39

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
SCHEMBL28614528 0.76 PPARG (0.47) PPARGPPARAPPARDALDH1A1HDAC1
SCHEMBL6579235 0.74 PPARG (0.51) PPARGPPARAPPARDPTPN1KMT2A
SCHEMBL6579224 0.73 PPARG (0.50) PPARGPPARAPPARDPTPN1ALDH1A1
SCHEMBL7150900 0.72 SRR (0.56) PPARGPPARAPPARDPTPN1ALDH1A1
SCHEMBL29163290 0.71 PPARG (0.65) PPARGPPARAPTPN1
SCHEMBL15446173 0.71 PPARG (0.52) PPARGPPARAPPARDHDAC1HDAC6
SCHEMBL15446189 0.71 PPARG (0.52) PPARGPPARAPPARDHDAC1HDAC6
SCHEMBL9076047 0.70 PPARG (0.48) PPARGPPARAPTPN1ALDH1A1ATM
SCHEMBL9076049 0.70 PPARG (0.48) PPARGPPARAPTPN1ALDH1A1ATM
SCHEMBL15451585 0.70 SRR (0.50) PPARGPPARAPTPN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1397341-A1 6-(ARYL-AMIDO OR ARYL-AMIDOMETHYL)-NAPHTHALEN-2-YLOXY-ACIDIC DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) Wyeth (US) 2004-03-17 EP disclosed
WO-2003000649-A1 6-(ARYL-AMIDO OR ARYL-AMIDOMETHYL)-NAPHTHALEN-2-YLOXY-ACIDIC DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR TYPE-1 (PAI-1) WYETH (US) 2003-01-03 WO disclosed