SCHEMBL9707360

SCHEMBL9707360

CC(=O)N(O)CCOc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 7/20 0.72
PTGS1 P23219 1/20 0.72
PTGS2 P35354 1/20 0.72
MAOB P27338 1/20 0.59
MMP2 P08253 1/20 0.57
MMP3 P08254 1/20 0.57
NR4A1 P22736 1/20 0.54
NR4A2 P43354 1/20 0.54
NR4A3 Q92570 1/20 0.54
EGFR P00533 2/20 0.53

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
SCHEMBL10617883 0.88 MMP2 (0.61) ALOX5PTGS1PTGS2MMP2MMP3
SCHEMBL9707448 0.85 MMP2 (0.72) ALOX5PTGS1PTGS2MMP2MMP3
SCHEMBL9707249 0.84 ALOX5 (1.00) ALOX5PTGS1PTGS2MAOBNR4A1
SCHEMBL9707259 0.81 PARP10 (0.56) ALOX5PTGS1PTGS2MAOBMMP2
SCHEMBL10617099 0.80 L3MBTL1 (0.54) ALOX5PTGS1PTGS2MMP2MMP3
SCHEMBL10619007 0.78 KCNA3 (0.53) ALOX5PTGS1PTGS2MMP2MMP3
SCHEMBL2477100 0.78 LTA4H (0.75) PTGS1PTGS2MAOBEGFR
SCHEMBL10617859 0.78 KDM4E (0.65) MMP2MMP3
SCHEMBL9707353 0.78 LSS (0.62) ALOX5PTGS1PTGS2MMP2MMP3
SCHEMBL9097342 0.77 EGFR (0.69) MAOBNR4A1NR4A2NR4A3EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0196184-B1 ARYL DERIVATIVES THE WELLCOME FOUNDATION LIMITED (GB) 1992-09-16 EP disclosed
US-5036157-A Hydroxamic acid derivatives, lipoxygenase and cyclooxygenase inhibitors, anticoagulants, antiinflammatory agents BURROUGHS WELLCOME CO. 1991-07-30 US disclosed
US-4977188-A Hydroamic acid derivatives BURROUGHS WELLCOME CO. (US) 1990-12-11 US disclosed
US-4738986-A CYCLOOXYGENASE, LIDOXYGENASE INHIBITORS BURROUGHS WELLCOME CO. (US) 1988-04-19 US disclosed
EP-0196184-A2 Aryl derivatives THE WELLCOME FOUNDATION LIMITED (GB) 1986-10-01 EP disclosed