SCHEMBL9009048

SCHEMBL9009048

CN(C)c1ccc2c(c1)Sc1cc(N(C)C)ccc1N2C(=O)c1ccccc1Cl

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.68
MEN1 O00255 2/20 0.68
KMT2A Q03164 2/20 0.68
TDP1 Q9NUW8 1/20 0.68
L3MBTL1 Q9Y468 1/20 0.68
BCHE P06276 5/20 0.47
LMNA P02545 6/20 0.46
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
GAA P10253 1/20 0.46
AVPR2 P30518 2/20 0.43
HTT P42858 1/20 0.41
SNCA P37840 1/20 0.41
POLB P06746 1/20 0.40
ALDH1A1 P00352 2/20 0.40
ACHE P22303 1/20 0.40
KDM4E B2RXH2 1/20 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
SCHEMBL9009060 0.86 MAPK1 (0.70) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL9009230 0.82 LMNA (0.68) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL10602592 0.81 MAPK1 (0.64) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL29406737 0.81 MEN1 (1.00) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL388483 0.81 MEN1 (1.00) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL9009195 0.79 TDP1 (0.76) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL22778911 0.78 MAPK1 (0.65) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL28497697 0.77 MAPK1 (0.65) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL30963493 0.77 MAPK1 (0.65) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL11143818 0.77 MEN1 (0.90) 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 2 patents. 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
US-4567019-A RAPID, REVERSIBLE THERMOCHROMISM GRAPHIC CONTROLS CORPORATION (US) 1986-01-28 US disclosed