SCHEMBL30444497

SCHEMBL30444497

CC1O[C@@H](CO)[C@H](c2ccccc2F)O1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
SLC5A2 P31639 2/20 0.36
POLB P06746 1/20 0.35
KDM1A O60341 3/20 0.34
KDM1B Q8NB78 1/20 0.34
RCOR1 Q9UKL0 1/20 0.34
GAA P10253 2/20 0.34
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
KDM4E B2RXH2 1/20 0.33
CYP2D6 P10635 2/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
IDO1 P14902 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL15540266 1.00 MEN1 (0.37) MEN1KMT2AHTR2CHTR2BSLC5A2
SCHEMBL16795878 1.00 MEN1 (0.37) MEN1KMT2AHTR2CHTR2BSLC5A2
SCHEMBL30445125 1.00 MEN1 (0.37) MEN1KMT2AHTR2CHTR2BSLC5A2
SCHEMBL18802133 1.00 MEN1 (0.37) MEN1KMT2AHTR2CHTR2BSLC5A2
SCHEMBL4083854 0.87 SLC5A2 (0.43) MEN1KMT2AHTR2CHTR2BSLC5A2
SCHEMBL3818874 0.87 SLC5A2 (0.43) MEN1KMT2AHTR2CHTR2BSLC5A2
SCHEMBL15538978 0.81 HTR2C (0.38) HTR2CHTR2BSLC5A2CYP2D6SLC6A2
SCHEMBL30443948 0.81 HTR2C (0.38) HTR2CHTR2BSLC5A2CYP2D6SLC6A2
SCHEMBL30443722 0.81 HTR2C (0.38) HTR2CHTR2BSLC5A2CYP2D6SLC6A2
SCHEMBL16795853 0.81 HTR2C (0.38) HTR2CHTR2BSLC5A2CYP2D6SLC6A2

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-116234798-A Sulfamate derivative compounds for the treatment or alleviation of psychotic disorders 生物药品解决方案有限公司 2023-06-06 CN disclosed