SCHEMBL28813383

SCHEMBL28813383

CC1Cc2c(O)ccc(O)c2C(=O)O1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAOA P21397 18/20 1.00
MAOB P27338 8/20 0.79
KDM4E B2RXH2 1/20 0.66
POLB P06746 1/20 0.66
MAPT P10636 1/20 0.66

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
SCHEMBL30487592 0.88 MAOA (1.00) MAOAMAOBKDM4EPOLBMAPT
SCHEMBL30487615 0.88 MAOA (1.00) MAOAMAOBKDM4EPOLBMAPT
SCHEMBL13925635 0.87 MAOA (0.77) MAOAMAOBKDM4EPOLBMAPT
SCHEMBL13925642 0.87 MAOA (0.77) MAOAMAOBKDM4EPOLBMAPT
SCHEMBL30487583 0.87 MAOA (0.77) MAOAMAOBKDM4EPOLBMAPT
SCHEMBL13925639 0.87 MAOA (0.77) MAOAMAOBKDM4EPOLBMAPT
SCHEMBL30487573 0.85 MAOB (1.00) MAOAMAOBKDM4EPOLBMAPT
SCHEMBL23484269 0.78 MAOB (0.62) MAOAMAOBKDM4EPOLBMAPT
SCHEMBL13851545 0.77 MAOA (0.63) MAOAMAOBKDM4EPOLBMAPT
Mellein SCHEMBL1230955 0.77 MAOA (1.00) MAOAMAOBKDM4EPOLBMAPT

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
CN-215538569-U Wulingshen extraction device 宁波卫生职业技术学院 2022-01-18 CN disclosed