SCHEMBL17848262

SCHEMBL17848262

O=CCc1cc(OCc2ccc(F)nc2)ccc1O

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 13/20 0.40
MAOA P21397 6/20 0.40
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
PRMT5 O14744 1/20 0.35
WDR77 Q9BQA1 1/20 0.35
HDAC1 Q13547 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
HDAC5 Q9UQL6 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
SCHEMBL3643405 0.79 MAOB (0.54) MAOBMAOAHDAC6
SCHEMBL17848261 0.76 MAOB (0.64) MAOBMAOAMAPT
SCHEMBL3218774 0.76 MAOB (0.58) MAOBMAOA
SCHEMBL114699 0.72 CYP11B1 (0.43) HDAC1
SCHEMBL3641442 0.72 MAOB (0.59) MAOBMAOAHDAC6
SCHEMBL17848427 0.71 MAOB (0.44) MAOBMAOAMAPT
SCHEMBL17848424 0.71 MAOB (0.44) MAOBMAOAMAPT
SCHEMBL5748867 0.70 LTA4H (0.44) MAPT
SCHEMBL874158 0.69 ERN1 (0.56) POLBMAPT
SCHEMBL4420136 0.69 APP (0.53) MAOBMAOA

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
WO-2016097345-A1 LABELLED CHROMONE DERIVATIVES GE HEALTHCARE LIMITED (GB) 2016-06-23 WO disclosed