SCHEMBL6194369

SCHEMBL6194369

O=c1ccoc(C(O)c2ccc(Br)cc2)c1O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
LMNA P02545 1/20 0.41
TEAD4 Q15561 2/20 0.36
APP P05067 3/20 0.34
MAOA P21397 2/20 0.33
MAOB P27338 2/20 0.33
ALOX15 P16050 1/20 0.33
FTO Q9C0B1 1/20 0.33
CYP2C19 P33261 1/20 0.32
CYP1A2 P05177 1/20 0.32
GLB1 P16278 1/20 0.32
CTRB1 P17538 1/20 0.32
CTRC Q99895 1/20 0.32
CFTR P13569 1/20 0.31
MAPK1 P28482 1/20 0.31
THRB P10828 1/20 0.31
XDH P47989 1/20 0.31

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
SCHEMBL6196007 0.84 KDM4E (0.41) KDM4ELMNAAPPMAOAMAOB
SCHEMBL6196974 0.84 KDM4E (0.49) KDM4ELMNATEAD4APPMAOA
SCHEMBL6195630 0.84 KDM4E (0.41) KDM4ELMNATEAD4APPMAOA
SCHEMBL6195700 0.83 LMNA (0.43) KDM4ELMNATEAD4APPMAOA
SCHEMBL6196526 0.80 KDM4E (0.41) KDM4ELMNAAPPFTO
SCHEMBL6198108 0.80 TOP2A (0.43) KDM4ELMNAAPPMAOAMAOB
SCHEMBL6195385 0.79 APP (0.56) KDM4ELMNAAPPTHRB
SCHEMBL6198121 0.76 NQO1 (0.44) KDM4ELMNATEAD4CYP1A2
SCHEMBL6193498 0.74 ALDH1A1 (0.44) CYP2C19CYP1A2MAPK1
SCHEMBL6197598 0.73 LMNA (0.53) LMNAMAOAMAOBTHRB

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-0768302-B1 Hydroxypyridinones NOVARTIS AG (CH) 2005-07-06 EP disclosed
US-5688815-A COMPOUNDS FOR REMOVAL OF EXCESS IRON IN MAMMALS CIBA GEIGY CORPORATION (US) 1997-11-18 US disclosed
EP-0768302-A2 Hydroxypyridinones Novartis AG (CH) 1997-04-16 EP disclosed