SCHEMBL11662037

SCHEMBL11662037

C=CC(OC(=O)CC)c1cccc2c1C(=O)NC2=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 5/20 0.39
▸ ALDH1A1 P00352 4/20 0.39
▸ GAA P10253 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ CASP3 P42574 10/20 0.35
▸ CASP2 P42575 2/20 0.35
▸ CASP7 P55210 2/20 0.35
▸ CASP6 P55212 2/20 0.35
▸ CASP8 Q14790 2/20 0.35
▸ MEN1 O00255 3/20 0.34
▸ KMT2A Q03164 3/20 0.34
▸ POLB P06746 1/20 0.34
▸ GSK3B P49841 2/20 0.33
▸ GSK3A P49840 1/20 0.33
▸ CDK5 Q00535 1/20 0.33
▸ CDK5R1 Q15078 1/20 0.33
▸ RXFP1 Q9HBX9 2/20 0.33
▸ PSD A5PKW4 1/20 0.30
▸ MAPK10 P53779 1/20 0.30

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
SCHEMBL11576358 0.85 KDM4E (0.43) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL22499607 0.73 KDM4E (0.42) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL28326979 0.73 ALDH1A1 (0.47) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL11615864 0.73 KDM4E (0.42) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL10416487 0.70 GSK3B (0.39) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL2312954 0.70 GSK3B (0.39) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL4975646 0.70 KDM4E (0.42) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL2247260 0.70 KDM4E (0.42) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL19667898 0.70 KDM4E (0.49) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL28176499 0.69 ALDH1A1 (0.48) KDM4EALDH1A1GAAHPGDHSD17B10

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-4106940-A N-ALKYLPHTHALIMIDE DERIVATIVE OIL FORMER AGFA-GEVAERT, A.G. (DE) 1978-08-15 — — US disclosed
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