SCHEMBL9670940

SCHEMBL9670940

CCOC(=O)n1c2ccccc2c(=O)n1Cc1cn(C(=O)OC(C)(C)C)c2ccccc12

nearest known ligand 0.65

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.65
▸ PDE10A Q9Y233 1/20 0.45
▸ EPHX1 P07099 1/20 0.45
▸ ACHE P22303 1/20 0.42
▸ HTR6 P50406 1/20 0.40
▸ ADAM17 P78536 1/20 0.39
▸ BRD4 O60885 1/20 0.38
▸ CREBBP Q92793 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PIM1 P11309 1/20 0.38
▸ MARK3 P27448 1/20 0.38
▸ MAP4K2 Q12851 1/20 0.38
▸ CAMK2B Q13554 1/20 0.38
▸ PIM3 Q86V86 1/20 0.38
▸ PIM2 Q9P1W9 1/20 0.38
▸ ATM Q13315 1/20 0.36

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
SCHEMBL1520892 0.79 L3MBTL1 (0.70) L3MBTL1PDE10AEPHX1ACHEHTR6
SCHEMBL10088115 0.79 L3MBTL1 (0.74) L3MBTL1PDE10AEPHX1ACHEHTR6
SCHEMBL5740608 0.79 L3MBTL1 (1.00) L3MBTL1PDE10AEPHX1ACHEHTR6
SCHEMBL9647061 0.79 L3MBTL1 (0.44) L3MBTL1KDM4EALDH1A1MEN1KMT2A
SCHEMBL16398958 0.77 L3MBTL1 (0.71) L3MBTL1PDE10AEPHX1ACHEHTR6
SCHEMBL29277143 0.76 L3MBTL1 (0.70) L3MBTL1PDE10AEPHX1ACHEHTR6
SCHEMBL24729176 0.76 L3MBTL1 (0.66) L3MBTL1PDE10AEPHX1ACHEHTR6
SCHEMBL22651784 0.76 L3MBTL1 (0.70) L3MBTL1PDE10AEPHX1ACHEHTR6
SCHEMBL30721514 0.76 L3MBTL1 (0.66) L3MBTL1PDE10AEPHX1ACHEHTR6
SCHEMBL4109142 0.76 L3MBTL1 (0.66) L3MBTL1PDE10AEPHX1ACHEHTR6

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
EP-0284174-B1 THERAPEUTIC PREPARATIONS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-07-29 — — EP disclosed
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