SCHEMBL11266840

SCHEMBL11266840

CCOC(=O)C1(CCc2cccc(C(F)(F)F)c2)CO1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.47
ALDH1A1 P00352 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KDM4E B2RXH2 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
MAOB P27338 2/20 0.43
FFAR4 Q5NUL3 1/20 0.43
MAPT P10636 4/20 0.42
LMNA P02545 2/20 0.42
ABCB11 O95342 1/20 0.42
MAPK1 P28482 1/20 0.42
HPGD P15428 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
HTT P42858 2/20 0.42
POLB P06746 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
PRKCA P17252 1/20 0.41
PRKCD Q05655 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
SCHEMBL11261814 0.93 MAPT (0.46) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL30451682 0.88 THRB (0.48) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11292203 0.88 MAPT (0.48) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11294373 0.88 MAPT (0.48) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11295197 0.87 MAPT (0.50) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11292125 0.87 MAPT (0.50) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11267692 0.83 HDAC1 (0.43) MAOBMAPTLMNAABCB11MAPK1
SCHEMBL11141400 0.82 HTR2A (0.45) THRBALDH1A1SMN1; SMN2KDM4ENPSR1
SCHEMBL11276117 0.82 MAPT (0.44) MAOBMAPTLMNAABCB11MAPK1
SCHEMBL11298722 0.82 LMNA (0.51) ALDH1A1KDM4EMAOBMAPTLMNA

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
US-4324796-A HYPOGLYCEMIC AGENTS, HYPOKETONEMIC AGENTS BYK GULDEN LOMBERG CHEMISCHE FABRIK GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1982-04-13 US disclosed