SCHEMBL7657806

SCHEMBL7657806

O=C(C=CC1=COC(Cc2ccccc2)O1)c1cc(Br)ccc1O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.51
MAPT P10636 6/20 0.48
NPSR1 Q6W5P4 4/20 0.48
ALDH1A1 P00352 3/20 0.48
HSP90AA1 P07900 3/20 0.48
KDM4E B2RXH2 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.47
MAOB P27338 2/20 0.47
MAOA P21397 1/20 0.47
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
THRB P10828 1/20 0.46
HPGD P15428 1/20 0.46
ALOX12 P18054 1/20 0.46
APEX1 P27695 1/20 0.46
HTT P42858 1/20 0.46
RECQL P46063 1/20 0.46

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
SCHEMBL7664550 0.88 MAPT (0.43) ARMAPTALDH1A1L3MBTL1MAOB
SCHEMBL7666145 0.87 MAOB (0.58) ARMAPTNPSR1ALDH1A1L3MBTL1
SCHEMBL7666636 0.87 AR (0.58) ARMAPTALDH1A1KDM4EL3MBTL1
SCHEMBL7664988 0.87 AR (0.52) ARMAPTNPSR1ALDH1A1HSP90AA1
SCHEMBL7662659 0.85 MAPT (0.50) MAPTALDH1A1KDM4EL3MBTL1MAOB
SCHEMBL7654658 0.84 APP (0.39) ARMAPTALDH1A1KDM4EL3MBTL1
SCHEMBL7658891 0.83 NPC1 (0.40) ARMAPTNPSR1ALDH1A1L3MBTL1
SCHEMBL7664261 0.81 AR (0.39) ARMAPTALDH1A1HSP90AA1KDM4E
SCHEMBL7661260 0.79 MAOB (0.41) ARMAPTNPSR1ALDH1A1HSP90AA1
SCHEMBL7654846 0.79 KDM4E (0.50) ARMAPTNPSR1KDM4EMAOB

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
US-6500846-B1 2-(4-CHLOROPHENYL)-7-METHOXYCHROMEN-4-ONE, AS CYCLIN-DEPENDENT KINASE INHIBITORS, USED AS ANTICARCINOGENIC AGENTS OR FOR PROPHYLAXIS OF NEURODEGENERATIVE DISEASE LG CHEMICAL, LTD. (KR) 2002-12-31 US disclosed
EP-1109800-A1 NOVEL CDK INHIBITORS HAVING FLAVONE STRUCTURE LG CHEMICAL LIMITED (KR) 2001-06-27 EP disclosed
WO-2000012496-A1 NOVEL CDK INHIBITORS HAVING FLAVONE STRUCTURE LG CHEMICAL LTD. (KR) 2000-03-09 WO disclosed