SCHEMBL6204780

SCHEMBL6204780

Fc1ccc(CCOc2ccc3c([c]cn3Cc3ccc(F)cc3)c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.43
MAOA P21397 2/20 0.43
EGFR P00533 3/20 0.38
IGF1R P08069 3/20 0.38
FLT4 P35916 3/20 0.38
KDR P35968 3/20 0.38
MCHR1 Q99705 2/20 0.38
PPARD Q03181 1/20 0.37
KDM4E B2RXH2 1/20 0.36
THRB P10828 1/20 0.35
C3AR1 Q16581 1/20 0.35
SLC2A1 P11166 1/20 0.34
S1PR1 P21453 1/20 0.34
S1PR3 Q99500 1/20 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
SCHEMBL29136198 0.78 MAPT (0.46) THRB
SCHEMBL3195439 0.76 PPARG (0.52) MAOBMAOAEGFRIGF1RFLT4
SCHEMBL27731280 0.76 SERPINE1 (0.44)
SCHEMBL2117187 0.74 CD74 (0.40) KDM4E
SCHEMBL3849945 0.73 ALDH1A1 (0.46) KDM4ETHRB
SCHEMBL27751710 0.72 SIRT2 (0.42) MAOBMAOAMCHR1
SCHEMBL4384076 0.72 KCNA3 (0.46) KDM4E
SCHEMBL15079869 0.70 MAOB (0.58) MAOBMAOA
SCHEMBL29136189 0.69 MAPT (0.47) KDM4E
SCHEMBL3206115 0.69 PLA2G2A (0.57) EGFRIGF1RFLT4KDRPPARD

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-1569901-A2 ARYL, ARYLOXY, AND ALKYLOXY SUBSTITUTED i 1H /i -INDOL-3-YL GLYOXYLIC ACID DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) Wyeth (US) 2005-09-07 EP disclosed
WO-2004052854-A2 ARYL, ARYLOXY, AND ALKYLOXY SUBSTITUTED 1H-INDOL-3-YL GLYOXYLIC ACID DERIVATIVES AS INHIBITORS OF PLASMINOGEN ACTIVATOR INHIBITOR-1 (PAI-1) WYETH (US) 2004-06-24 WO disclosed