SCHEMBL9009016

SCHEMBL9009016

COc1ccccc1C(=O)N1c2ccc(-c3ccc(N(C)C)cc3)cc2Sc2cc(-c3ccc(N(C)C)cc3)ccc21

nearest known ligand 0.62

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.62
MAPK1 P28482 2/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
MAPT P10636 3/20 0.47
HTT P42858 2/20 0.47
BCHE P06276 7/20 0.45
ACHE P22303 4/20 0.45
KLKB1 P03952 1/20 0.42
KLK1 P06870 1/20 0.42
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HPGD P15428 1/20 0.40
SNCA P37840 1/20 0.39
NPC1 O15118 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RAB9A P51151 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
SCHEMBL9009230 0.91 LMNA (0.68) LMNAMAPK1MEN1KMT2ATDP1
SCHEMBL9009014 0.85 LMNA (0.60) LMNAMAPK1MEN1KMT2ATDP1
SCHEMBL9009183 0.81 MAPK1 (0.81) LMNAMAPK1MEN1KMT2ATDP1
SCHEMBL9008971 0.80 MEN1 (0.59) LMNAMAPK1MEN1KMT2ATDP1
SCHEMBL22323680 0.78 LMNA (1.00) LMNAMAPTHTTBCHEACHE
SCHEMBL9009128 0.78 MEN1 (0.63) MAPK1MEN1KMT2ATDP1L3MBTL1
SCHEMBL9009060 0.75 MAPK1 (0.70) LMNAMAPK1MEN1KMT2ATDP1
SCHEMBL9009048 0.74 MAPK1 (0.68) LMNAMAPK1MEN1KMT2ATDP1
SCHEMBL9009153 0.72 KMT2A (0.56) LMNAMAPK1MEN1KMT2ATDP1
SCHEMBL8981610 0.72 MAPK1 (0.65) LMNAMAPK1MEN1KMT2ATDP1

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