SCHEMBL11275361

SCHEMBL11275361

CCN(CC(O)CN)c1ccc2c(=O)[nH][nH]c(=O)c2c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.60
▸ TDP1 Q9NUW8 4/20 0.60
▸ ALDH1A1 P00352 8/20 0.36
▸ MAPT P10636 5/20 0.36
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ GRK6 P43250 1/20 0.36
▸ AR P10275 4/20 0.35
▸ L3MBTL1 Q9Y468 5/20 0.35
▸ HSD17B10 Q99714 5/20 0.35
▸ HPGD P15428 3/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ GLA P06280 5/20 0.35
▸ ATM Q13315 4/20 0.35
▸ CYP3A4 P08684 3/20 0.35
▸ CASP1 P29466 3/20 0.35
▸ CASP7 P55210 3/20 0.35
▸ IGLV6-57 P01721 2/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ ELANE P08246 1/20 0.34

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
SCHEMBL3780116 0.81 KDM4E (0.68) KDM4ETDP1ALDH1A1MAPTMEN1
SCHEMBL29421600 0.79 KDM4E (0.80) KDM4ETDP1ALDH1A1MAPTMEN1
SCHEMBL3075296 0.79 KDM4E (0.80) KDM4ETDP1ALDH1A1MAPTMEN1
SCHEMBL12909466 0.76 KDM4E (0.62) KDM4ETDP1ALDH1A1MAPTMEN1
SCHEMBL14321770 0.76 KDM4E (0.97) KDM4ETDP1ALDH1A1MAPTMEN1
SCHEMBL29394268 0.76 KDM4E (0.97) KDM4ETDP1ALDH1A1MAPTMEN1
SCHEMBL437558 0.76 KDM4E (0.97) KDM4ETDP1ALDH1A1MAPTMEN1
SCHEMBL436768 0.75 KDM4E (1.00) KDM4ETDP1ALDH1A1MAPTMEN1
SCHEMBL29421583 0.75 KDM4E (1.00) KDM4ETDP1ALDH1A1MAPTMEN1
SCHEMBL11497939 0.74 ALDH1A1 (0.47) KDM4ETDP1ALDH1A1MAPTL3MBTL1

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
US-4363759-A PHOTOSENSITIVE MILES LABORATORIES, INC. (US) 1982-12-14 — — US disclosed
US-4355165-A CHEMILUMIMESCENCE, IMMUNOASSAY MILES LABORATORIES, INC. (US) 1982-10-19 — — US disclosed
US-4261893-A INTERMEDIATES IN SYNTHESIS OF CHEMILUMINESCENT-LABELED CONJUGATES USED IN IMMUNOASSAYS MILES LABORATORIES, INC. (US) 1981-04-14 — — US disclosed
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