SCHEMBL27770762

SCHEMBL27770762

CC(C)(C)NC(=O)OCC(N)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.46
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
SCN4A P35499 7/20 0.44
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ROCK2 O75116 1/20 0.41
ROCK1 Q13464 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
PKM P14618 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
TACR1 P25103 4/20 0.40

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
SCHEMBL28763014 0.85 ADRB2 (0.43) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL28136985 0.84 SLC6A2 (0.41) KMT2AMEN1CYP1A2CYP2D6
SCHEMBL28076445 0.84 ALDH1A1 (0.40) LMNAROCK2ROCK1SMN1; SMN2
SCHEMBL28830732 0.84 PSEN1 (0.44) MAPTLMNASCN4ASMN1; SMN2NPSR1
SCHEMBL28170860 0.83 MAPT (0.47) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL12682063 0.83 CYP1A2 (0.50) KMT2ASCN4ACYP1A2CYP2D6PKM
SCHEMBL28041869 0.81 ALDH1A1 (0.43) MAPTKMT2AMEN1LMNAL3MBTL1
SCHEMBL28094567 0.79 DPP4 (0.39) MAPT
SCHEMBL7100081 0.77 SCN4A (0.52) KMT2ASCN4ACYP1A2CYP2D6PKM
SCHEMBL22502128 0.77 SCN4A (0.52) KMT2ASCN4ACYP1A2CYP2D6PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103896831-A 4-(4-pyridinyl)-benzamides and their use as rock activity modulators ABBVIE DEUTSCHLAND 2014-07-02 CN disclosed
CN-101903349-B 4- (4-pyridinyl) -benzamides and their use as ROCK activity modulators ABBOTT GMBH & CO KG 2014-01-08 CN disclosed
CN-103429593-A Imidazo pyrazines HOFFMANN LA ROCHE 2013-12-04 CN disclosed
CN-101646427-B Inhibitors of akt activity SMITHKLINE BEECHAM CORP US 2013-06-12 CN disclosed
CN-101790526-A 5-heteroaryl substituted indazoles as kinase inhibitors ABBOTT GMBH & CO KG 2010-07-28 CN disclosed
CN-101646427-A Inhibitors of akt activity SMITHKLINE BEECHAM CORP US 2010-02-10 CN disclosed