SCHEMBL3264516

SCHEMBL3264516

C[C@H](Nc1cc(-c2ccccc2)nc(Nc2ccc(C3CCC3CC(=O)O)cc2)n1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CAMK2D Q13557 11/20 0.45
VCP P55072 3/20 0.44
PLK1 P53350 1/20 0.40
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
LDHA P00338 1/20 0.38
LDHB P07195 1/20 0.38
SYK P43405 1/20 0.38
PFKFB3 Q16875 1/20 0.37
OGG1 O15527 1/20 0.37

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
SCHEMBL3263503 1.00 CAMK2D (0.45) CAMK2DVCPPLK1MEN1KMT2A
SCHEMBL3234459 0.77 CAMK2D (0.45) CAMK2DVCPPLK1MEN1KMT2A
SCHEMBL3420476 0.77 CAMK2D (0.45) CAMK2DVCPPLK1MEN1KMT2A
SCHEMBL13309648 0.75 CAMK2D (0.45) CAMK2DVCPPLK1MEN1KMT2A
SCHEMBL3227477 0.75 CAMK2D (0.45) CAMK2DVCPPLK1MEN1KMT2A
SCHEMBL13309649 0.75 CAMK2D (0.45) CAMK2DVCPPLK1MEN1KMT2A
SCHEMBL3421997 0.73 CAMK2D (0.45) CAMK2DPLK1LDHALDHBSYK
SCHEMBL3264612 0.73 CAMK2D (0.45) CAMK2DPLK1LDHALDHBSYK
SCHEMBL3264514 0.73 CAMK2D (0.43) CAMK2DVCPPLK1MEN1KMT2A
SCHEMBL3263499 0.73 CAMK2D (0.43) CAMK2DVCPPLK1MEN1KMT2A

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
WO-2010028179-A1 HETEROCYCLIC COMPOUNDS AS GATA MODULATORS DR. REDDY'S LABORATORIES LTD. (IN) 2010-03-11 WO disclosed