SCHEMBL30451682

SCHEMBL30451682

CCOC(=O)C1(Cc2cccc(C(F)(F)F)c2)CO1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.48
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
KDM4E B2RXH2 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
MAOB P27338 2/20 0.44
MAPT P10636 2/20 0.43
HPGD P15428 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
HTT P42858 3/20 0.43
POLB P06746 1/20 0.43
LMNA P02545 1/20 0.43
PRKCA P17252 1/20 0.43
PRKCD Q05655 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
GFER P55789 1/20 0.41

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
SCHEMBL29141888 0.93 MAPT (0.43) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11266840 0.88 THRB (0.47) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11261814 0.86 MAPT (0.46) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11141400 0.84 HTR2A (0.45) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL30450291 0.82 LMNA (0.48) NPSR1MAOBMAPTMEN1KMT2A
SCHEMBL11294373 0.81 MAPT (0.48) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11292203 0.81 MAPT (0.48) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
Hydrochloric Acid SCHEMBL25400192 0.80 KMT2A (0.41) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11295197 0.80 MAPT (0.50) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11292125 0.80 MAPT (0.50) THRBALDH1A1SMN1; SMN2KDM4ENPSR1

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-115894195-A Method for preparing 1-aryl-3-substituted acetone compound and intermediate 迈克斯(如东)化工有限公司 2023-04-04 CN disclosed