SCHEMBL8619926

SCHEMBL8619926

C=C(C)C(=O)Oc1c(C)ccc2c1C(=O)c1ccccc1C2=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 5/20 0.51
▸ ALDH1A1 P00352 6/20 0.48
▸ MAPK1 P28482 5/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ NPC1 O15118 3/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ CYP3A4 P08684 3/20 0.48
▸ L3MBTL1 Q9Y468 3/20 0.48
▸ TSHR P16473 2/20 0.48
▸ CASP3 P42574 1/20 0.48
▸ HBB P68871 1/20 0.48
▸ SENP7 Q9BQF6 1/20 0.48
▸ SENP6 Q9GZR1 1/20 0.48
▸ MAPT P10636 6/20 0.42
▸ MITF O75030 1/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ MAOA P21397 2/20 0.41
▸ TTR P02766 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40

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
SCHEMBL8622400 0.80 TTR (0.56) ELANEALDH1A1MAPK1SMN1; SMN2NPC1
SCHEMBL3419749 0.76 SMN1; SMN2 (0.70) ELANEALDH1A1MAPK1SMN1; SMN2NPC1
SCHEMBL10489364 0.74 ELANE (0.53) ELANEALDH1A1MAPK1SMN1; SMN2NPC1
SCHEMBL447625 0.73 ALDH1A1 (0.49) ELANEALDH1A1SMN1; SMN2L3MBTL1TSHR
SCHEMBL28527666 0.73 SMN1; SMN2 (0.56) ELANEALDH1A1MAPK1SMN1; SMN2NPC1
SCHEMBL23637659 0.72 ELANE (0.51) ELANEALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL13609807 0.72 ALDH1A1 (0.52) ELANEALDH1A1MAPK1SMN1; SMN2NPC1
SCHEMBL17460658 0.71 MEN1 (0.56) ELANEALDH1A1MAPK1SMN1; SMN2NPC1
SCHEMBL819579 0.71 MAPT (0.42) ELANEALDH1A1MAPK1L3MBTL1TSHR
SCHEMBL4645309 0.71 SMN1; SMN2 (0.58) ELANEALDH1A1MAPK1SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0842112-A1 AQUEOUS PHASE PRODUCTION OF HYDROGEN PEROXIDE AND CATALYSTS FOR USE THEREIN Peroxco Inc. (CA) 1998-05-20 — — EP claimed
US-5624543-A OXIDATION OF POLYMER-LINKED ANTHRAHYDROQUINONE PEROXCO INCORPORATED (CA) 1997-04-29 — — US claimed
WO-1997005058-A1 AQUEOUS PHASE PRODUCTION OF HYDROGEN PEROXIDE AND CATALYSTS FOR USE THEREIN PEROXCO INC. (CA) 1997-02-13 — — WO claimed
EP-0842112-A1 AQUEOUS PHASE PRODUCTION OF HYDROGEN PEROXIDE AND CATALYSTS FOR USE THEREIN Peroxco Inc. (CA) 1998-05-20 — — EP disclosed
US-5624543-A OXIDATION OF POLYMER-LINKED ANTHRAHYDROQUINONE PEROXCO INCORPORATED (CA) 1997-04-29 — — US disclosed
WO-1997005058-A1 AQUEOUS PHASE PRODUCTION OF HYDROGEN PEROXIDE AND CATALYSTS FOR USE THEREIN PEROXCO INC. (CA) 1997-02-13 — — WO disclosed
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