SCHEMBL9009014

SCHEMBL9009014

COc1ccccc1C(=O)N1c2ccc(-c3ccccc3N(C)C)cc2Sc2cc(-c3ccccc3N(C)C)ccc21

nearest known ligand 0.60

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.60
MAPT P10636 2/20 0.46
HTT P42858 2/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
BCHE P06276 6/20 0.43
ACHE P22303 4/20 0.43
BRD4 O60885 1/20 0.39
BRPF1 P55201 1/20 0.39
HPGD P15428 1/20 0.38
TP53 P04637 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
RORC P51449 1/20 0.37
RORB Q92753 1/20 0.37
ALDH1A1 P00352 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
SCHEMBL9009016 0.85 LMNA (0.62) LMNAMAPTHTTMEN1KMT2A
SCHEMBL9008969 0.83 BCHE (0.60) MEN1KMT2AMAPK1TDP1L3MBTL1
SCHEMBL9009230 0.82 LMNA (0.68) LMNAMAPTHTTMEN1KMT2A
SCHEMBL9009176 0.82 MEN1 (0.65) MEN1KMT2AMAPK1TDP1L3MBTL1
SCHEMBL9009125 0.81 BCHE (0.57) LMNAMAPTMEN1KMT2AMAPK1
SCHEMBL9009147 0.76 MEN1 (0.49) LMNAMEN1KMT2AMAPK1TDP1
SCHEMBL22323680 0.76 LMNA (1.00) LMNAMAPTHTTBCHEACHE
SCHEMBL27593699 0.71 BCHE (0.66) LMNAMAPTHTTL3MBTL1BCHE
SCHEMBL9009034 0.70 MEN1 (0.55) MEN1KMT2AMAPK1TDP1L3MBTL1
SCHEMBL22147543 0.70 LMNA (0.79) LMNAMAPTHTTMEN1KMT2A

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