SCHEMBL9360541

SCHEMBL9360541

CCOC1=C(c2ccccc2)C(=O)NC1=O

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 5/20 0.49
▸ GSK3B P49841 8/20 0.46
▸ PTPN1 P18031 1/20 0.42
▸ PDE4B Q07343 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ STK10 O94804 1/20 0.38
▸ SLK Q9H2G2 1/20 0.38

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
SCHEMBL27804436 0.90 GSK3B (0.47) PTGS2GSK3BPTPN1PDE4BSTK10
SCHEMBL2837669 0.87 PTPN1 (0.58) PTGS2GSK3BPTPN1
SCHEMBL211025 0.79 PDE4B (0.59) PTGS2GSK3BPDE4BALDH1A1STK10
SCHEMBL27825209 0.78 GSK3B (0.42) PTGS2GSK3B
SCHEMBL9436192 0.78 GSK3B (0.42) PTGS2GSK3BALDH1A1
SCHEMBL3719735 0.78 PTGS2 (0.51) PTGS2GSK3BPDE4B
SCHEMBL114611 0.76 PTGS2 (0.67) PTGS2GSK3BPDE4B
SCHEMBL94149 0.75 GSK3B (0.58) PTGS2GSK3BPDE4B
SCHEMBL15349924 0.74 TDP1 (0.50) PTGS2GSK3BALDH1A1
SCHEMBL5434280 0.74 GSK3B (0.52) PTGS2GSK3BSLK

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-0393713-B1 Process for the preparation of N-substituted maleimides TOSOH CORP (JP) 1994-06-29 — — EP disclosed
US-5087705-A Heating N-substituted maleamic acid monoester in presence of acid catalyst SHIN-DAIKYOWA PETROCHEMICAL CO., LTD. (JP) 1992-02-11 — — US disclosed
EP-0393713-A1 Process for the preparation of N-substituted maleimides Tosoh Corporation (JP) 1990-10-24 — — EP disclosed
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