SCHEMBL9355283

SCHEMBL9355283

N#CCC(=O)Nc1cccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.60
MAPT P10636 3/20 0.56
ALDH1A1 P00352 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
POLB P06746 1/20 0.56
GAA P10253 1/20 0.56
DNMT1 P26358 1/20 0.56
RAD52 P43351 1/20 0.56
SMARCA2 P51531 1/20 0.56
TERT O14746 8/20 0.55
MAPK1 P28482 2/20 0.54
RAB9A P51151 2/20 0.54
EGFR P00533 1/20 0.54
PABPC1 P11940 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KDM4E B2RXH2 1/20 0.51
HSD17B10 Q99714 1/20 0.51

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
SCHEMBL3381039 0.81 MAOA (0.65) MAOAMAPTALDH1A1MEN1KMT2A
SCHEMBL8602265 0.81 MAOA (0.69) MAOAMAPTALDH1A1MEN1KMT2A
SCHEMBL14579485 0.81 MAOA (0.65) MAOAMAPTALDH1A1MEN1KMT2A
SCHEMBL11549167 0.79 MAOA (0.72) MAOAMAPTALDH1A1MEN1KMT2A
SCHEMBL9442187 0.79 ALDH1A1 (0.68) ALDH1A1MEN1KMT2AGAAMAPK1
SCHEMBL10916179 0.79 KDM4E (0.61) MAPTALDH1A1MEN1KMT2APOLB
SCHEMBL8700766 0.78 MEN1 (0.64) MAOAMAPTALDH1A1MEN1KMT2A
SCHEMBL5804635 0.78 MEN1 (0.68) MAOAMAPTALDH1A1MEN1KMT2A
SCHEMBL9851275 0.77 MAOA (0.60) MAOAMAPTALDH1A1MEN1KMT2A
SCHEMBL10913800 0.77 HSD17B10 (0.66) MAPTALDH1A1MEN1KMT2APOLB

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0368750-B1 Process for preparing substituted aminoanthraquinones SUMITOMO CHEMICAL CO (JP) 1994-10-26 EP disclosed
US-5017713-A Alkylation SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1991-05-21 US disclosed
EP-0368750-A2 Process for preparing substituted aminoanthraquinones SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-05-16 EP disclosed