SCHEMBL366400

SCHEMBL366400

CCOC(=O)c1c2ccccc2n2cc(OC(C)CO)ccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ KDM4E B2RXH2 10/20 0.45
▸ ALDH1A1 P00352 8/20 0.45
▸ MEN1 O00255 5/20 0.45
▸ KMT2A Q03164 5/20 0.45
▸ MAPT P10636 3/20 0.45
▸ SAE1 Q9UBE0 2/20 0.45
▸ UBA2 Q9UBT2 2/20 0.45
▸ APAF1 O14727 1/20 0.45
▸ G6PD P11413 1/20 0.45
▸ PABPC1 P11940 1/20 0.45
▸ CACNA1B Q00975 1/20 0.45
▸ APBA1 Q02410 1/20 0.45
▸ GAA P10253 4/20 0.43
▸ HTT P42858 1/20 0.43
▸ CYP1A2 P05177 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ ATM Q13315 2/20 0.42
▸ IDO1 P14902 1/20 0.42

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
SCHEMBL366953 0.89 ALDH1A1 (0.46) POLBSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL366424 0.87 POLB (0.42) POLBSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL366504 0.86 KDM4E (0.44) POLBSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL366158 0.85 KDM4E (0.43) POLBSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL365518 0.85 ALDH1A1 (0.40) POLBSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL364969 0.83 KDM4E (0.53) POLBKDM4EALDH1A1MEN1KMT2A
SCHEMBL366399 0.83 ALDH1A1 (0.64) POLBSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL365367 0.83 ALDH1A1 (0.42) POLBSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL365589 0.83 GABRP (0.42) POLBSMN1; SMN2KDM4EALDH1A1MEN1
SCHEMBL367530 0.83 POLB (0.42) POLBSMN1; SMN2KDM4EALDH1A1MEN1

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
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 — — WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 — — WO disclosed
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