SCHEMBL9009060

SCHEMBL9009060

Cc1ccccc1C(=O)N1c2ccc(N(C)C)cc2Sc2cc(N(C)C)ccc21

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.70
MEN1 O00255 1/20 0.70
KMT2A Q03164 1/20 0.70
TDP1 Q9NUW8 1/20 0.70
L3MBTL1 Q9Y468 1/20 0.70
BCHE P06276 9/20 0.66
LMNA P02545 4/20 0.45
MAPT P10636 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
ALOX12 P18054 1/20 0.43
HTT P42858 1/20 0.42
SNCA P37840 1/20 0.42
ELANE P08246 1/20 0.40
ACHE P22303 1/20 0.39
ENPP3 O14638 1/20 0.39
ALPL P05186 1/20 0.39
XIAP P98170 1/20 0.39

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
SCHEMBL9009048 0.86 MAPK1 (0.68) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL9009230 0.84 LMNA (0.68) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL10602592 0.83 MAPK1 (0.64) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL388483 0.82 MEN1 (1.00) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL29406737 0.82 MEN1 (1.00) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL7194601 0.78 MEN1 (0.78) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL11143818 0.78 MEN1 (0.90) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL29557693 0.77 MAPK1 (0.67) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL1208061 0.77 MAPK1 (0.67) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL13019550 0.77 MEN1 (0.88) MAPK1MEN1KMT2ATDP1L3MBTL1

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-5565402-A RECORDING LAYER CONTAINING BLACK-FORMING FLUORAN DERIVATIVE AS BASIC DYE, PHENOTHIAZINE DERIVATIVE, DIPHENYL SULFONE DERIVATIVE COLOR ACCEPTOR NEW OJI PAPER CO., LTD. (JP) 1996-10-15 US disclosed