SCHEMBL4382002

SCHEMBL4382002

O=C1c2ccccc2C(=O)C1C1c2ccccc2Oc2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
ATM Q13315 1/20 0.44
GAA P10253 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
CYP2C9 P11712 2/20 0.41
S100A4 P26447 1/20 0.40

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
SCHEMBL8516774 0.83 MAOA (0.54) MAOAMAOBMEN1KMT2AATM
SCHEMBL19458502 0.82 MAOA (0.64) MAOAMAOBMEN1KMT2AATM
SCHEMBL17179933 0.74 PSD (0.41) MAOAMAOBMEN1KMT2APOLB
SCHEMBL28429456 0.74 ACHE (0.47) MAOAMAOBATMGAAHDAC3
SCHEMBL8295320 0.73 MAOA (0.44) MAOAMAOBMEN1KMT2APOLB
SCHEMBL5640220 0.73 MAOA (0.44) MAOAMAOBMEN1KMT2APOLB
SCHEMBL4422553 0.73 ATM (0.46) MAOAMAOBMEN1KMT2APOLB
Hydrochloric Acid SCHEMBL30317832 0.73 PSD (0.40) MAOAMAOBMEN1KMT2APOLB
SCHEMBL21448621 0.73 MAOA (0.44) MAOAMAOBMEN1KMT2APOLB
SCHEMBL4422548 0.73 ATM (0.46) MAOAMAOBMEN1KMT2APOLB

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
US-7629400-B2 Image making medium HYMAN SYDNEY 2009-12-08 US disclosed
US-20030035917-A1 Image making medium HYMAN SYDNEY (US) 2003-02-20 US disclosed