SCHEMBL7666145

SCHEMBL7666145

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

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.58
AR P10275 3/20 0.51
ALDH1A1 P00352 1/20 0.44
APEX1 P27695 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAOA P21397 1/20 0.43
GUSB P08236 1/20 0.43
MAPT P10636 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
BCHE P06276 1/20 0.38
CYP2C19 P33261 1/20 0.38

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) MAOBARALDH1A1MAOAGUSB
SCHEMBL7657806 0.87 AR (0.51) MAOBARALDH1A1APEX1TDP1
SCHEMBL7666636 0.87 AR (0.58) MAOBARALDH1A1TDP1MAOA
SCHEMBL7661260 0.87 MAOB (0.41) MAOBARALDH1A1APEX1TDP1
SCHEMBL7662659 0.85 MAPT (0.50) MAOBALDH1A1TDP1MAOAMAPT
SCHEMBL7654658 0.84 APP (0.39) MAOBARALDH1A1TDP1GUSB
SCHEMBL7658891 0.83 NPC1 (0.40) MAOBARALDH1A1GUSBMAPT
SCHEMBL7664261 0.81 AR (0.39) MAOBARALDH1A1TDP1MAOA
SCHEMBL7664988 0.79 AR (0.52) ARALDH1A1APEX1TDP1MAPT
SCHEMBL7654846 0.79 KDM4E (0.50) MAOBARTDP1MAOAMAPT

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 1 patent. 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