SCHEMBL9026259

SCHEMBL9026259

CC(C)(C)OC(=O)n1cc(CCC(C#N)N=C(c2ccccc2)c2ccccc2)c2ccccc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.49
PDE10A Q9Y233 1/20 0.44
EPHX1 P07099 1/20 0.44
ADAM17 P78536 1/20 0.41
HTR6 P50406 1/20 0.41
AAK1 Q2M2I8 1/20 0.40
ACHE P22303 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PIM1 P11309 1/20 0.37
MARK3 P27448 1/20 0.37
MAP4K2 Q12851 1/20 0.37
CAMK2B Q13554 1/20 0.37
PIM3 Q86V86 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
OXER1 Q8TDS5 1/20 0.36
BRD4 O60885 1/20 0.34
CREBBP Q92793 1/20 0.34
CCKAR P32238 2/20 0.34
CCKBR P32239 2/20 0.34

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
SCHEMBL9025939 0.81 L3MBTL1 (0.55) L3MBTL1PDE10AEPHX1ADAM17HTR6
SCHEMBL30762034 0.80 L3MBTL1 (0.56) L3MBTL1PDE10AEPHX1ADAM17HTR6
SCHEMBL3132751 0.77 L3MBTL1 (0.61) L3MBTL1PDE10AEPHX1ADAM17HTR6
SCHEMBL31126240 0.75 L3MBTL1 (0.63) L3MBTL1PDE10AEPHX1ADAM17HTR6
SCHEMBL273000 0.75 L3MBTL1 (0.63) L3MBTL1PDE10AEPHX1ADAM17HTR6
SCHEMBL4109142 0.74 L3MBTL1 (0.66) L3MBTL1PDE10AEPHX1ADAM17HTR6
SCHEMBL22651784 0.74 L3MBTL1 (0.70) L3MBTL1PDE10AEPHX1ADAM17HTR6
SCHEMBL30721514 0.74 L3MBTL1 (0.66) L3MBTL1PDE10AEPHX1ADAM17HTR6
SCHEMBL25907970 0.74 AAK1 (0.50) AAK1
SCHEMBL4892277 0.73 L3MBTL1 (0.65) L3MBTL1PDE10AEPHX1ADAM17HTR6

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0411150-B1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMA CO LTD (JP) 1996-11-27 EP disclosed
US-5238938-A Nephrosis OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-24 US disclosed
EP-0411150-A1 INDOLE DERIVATIVES, PREPARATION THEREOF, AND DRUG FOR PREVENTING AND TREATING NEPHRITIS CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-02-06 EP disclosed