SCHEMBL9720959

SCHEMBL9720959

Cc1ccc(CN2C(=S)c3cccc4cccc2c34)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.51
UBE2N P61088 3/20 0.51
HPGD P15428 3/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
ATM Q13315 1/20 0.51
ALDH1A1 P00352 5/20 0.45
KDM4E B2RXH2 4/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
CASP1 P29466 1/20 0.44
MPI P34949 1/20 0.44
CACNA1B Q00975 1/20 0.44
APBA1 Q02410 1/20 0.44
TDP1 Q9NUW8 2/20 0.43
MAPT P10636 3/20 0.42
TP53 P04637 1/20 0.42
MEN1 O00255 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 1/20 0.42
CLTC Q00610 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL9720892 0.87 UBE2N (0.52) LMNAUBE2NHPGDL3MBTL1ATM
SCHEMBL9720913 0.86 NPSR1 (0.55) LMNAUBE2NHPGDL3MBTL1ATM
SCHEMBL9720994 0.82 UBE2N (0.74) LMNAUBE2NHPGDL3MBTL1ATM
SCHEMBL9721010 0.77 CMA1 (0.52) UBE2NHPGDL3MBTL1ATMALDH1A1
SCHEMBL9720885 0.76 KDM4E (0.61) LMNAUBE2NHPGDL3MBTL1ATM
SCHEMBL9720888 0.74 ALDH1A1 (0.47) LMNAUBE2NHPGDL3MBTL1ATM
SCHEMBL9720883 0.74 UBE2N (0.50) LMNAUBE2NHPGDL3MBTL1ATM
SCHEMBL11373888 0.72 HEXA (0.57) LMNAHPGDL3MBTL1ALDH1A1KDM4E
SCHEMBL9721061 0.71 NPSR1 (0.49) LMNAUBE2NHPGDL3MBTL1ATM
SCHEMBL9290314 0.71 ALDH1A1 (0.44) LMNAUBE2NHPGDL3MBTL1ATM

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
US-5079247-A N1 -substituted benz(cd)indol-2-imine compounds as cardiovascular agents AMERICAN CYANAMID COMPANY (US) 1992-01-07 US disclosed