SCHEMBL8220489

SCHEMBL8220489

COc1cc(C=C2NC(=O)NC2=O)ccc1OCC(=O)N1CCOCC1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 6/20 0.70
▸ ALDH1A1 P00352 5/20 0.70
▸ MAPT P10636 4/20 0.70
▸ GSK3B P49841 1/20 0.70
▸ HPGD P15428 1/20 0.61
▸ HSD17B10 Q99714 1/20 0.61
▸ POLB P06746 2/20 0.58
▸ GAA P10253 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ MAPK1 P28482 2/20 0.54
▸ KLK7 P49862 1/20 0.53
▸ HTT P42858 2/20 0.51
▸ MITF O75030 1/20 0.50
▸ CACNA1B Q00975 1/20 0.50
▸ APBA1 Q02410 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ TP53 P04637 1/20 0.48

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
SCHEMBL8220477 1.00 KDM4E (0.70) KDM4EALDH1A1MAPTGSK3BHPGD
SCHEMBL8220485 1.00 KDM4E (0.70) KDM4EALDH1A1MAPTGSK3BHPGD
SCHEMBL8218393 0.91 KDM4E (0.66) KDM4EALDH1A1MAPTGSK3BHPGD
SCHEMBL8218397 0.91 KDM4E (0.66) KDM4EALDH1A1MAPTGSK3BHPGD
SCHEMBL8218399 0.91 KDM4E (0.66) KDM4EALDH1A1MAPTGSK3BHPGD
SCHEMBL31428766 0.83 ALDH1A1 (0.62) KDM4EALDH1A1MAPTGSK3BHPGD
SCHEMBL5692309 0.81 ALDH1A1 (1.00) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL31428602 0.81 ALDH1A1 (1.00) KDM4EALDH1A1MAPTHPGDHSD17B10
SCHEMBL3125849 0.76 GSK3B (0.70) KDM4EALDH1A1MAPTGSK3BPOLB
SCHEMBL3125853 0.76 GSK3B (0.70) KDM4EALDH1A1MAPTGSK3BPOLB

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-8188130-B1 Anti-cancer hydantoin compounds and methods UNIVERSITY OF LOUISIANA AT MONROE (US) 2012-05-29 — — US claimed
US-8188130-B1 Anti-cancer hydantoin compounds and methods UNIVERSITY OF LOUISIANA AT MONROE (US) 2012-05-29 — — US disclosed
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