SCHEMBL7600157

SCHEMBL7600157

C=CCc1ccc2c(c1CC=C)C(=O)c1ccccc1C2=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ELANE P08246 3/20 0.48
▸ ALDH1A1 P00352 7/20 0.41
▸ MAPK1 P28482 6/20 0.41
▸ MAPT P10636 6/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ MEN1 O00255 4/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ MAOA P21397 2/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ MCL1 Q07820 2/20 0.41
▸ ALOX12 P18054 2/20 0.41
▸ MAOB P27338 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ BCL2 P10415 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ APEX1 P27695 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ DAPK1 P53355 1/20 0.41
▸ CYP1B1 Q16678 1/20 0.41

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
SCHEMBL28848100 0.91 ELANE (0.46) ELANEALDH1A1MAPK1MAPTKMT2A
SCHEMBL11412142 0.83 GABRA1 (0.46) ELANEALDH1A1MAPK1MAPTKMT2A
SCHEMBL30497048 0.83 ELANE (0.67) ELANEALDH1A1MAPK1MAPTKMT2A
SCHEMBL9282673 0.83 MAOA (0.56) ELANEALDH1A1MAPK1MAPTKMT2A
SCHEMBL9355397 0.83 MAOA (0.56) ELANEALDH1A1MAPK1MAPTKMT2A
SCHEMBL2834207 0.83 ELANE (0.67) ELANEALDH1A1MAPK1MAPTKMT2A
SCHEMBL38652483 0.81 GABRA1 (0.50) ELANEALDH1A1MAPK1MAPTKMT2A
SCHEMBL175397 0.81 GABRA1 (0.50) ELANEALDH1A1MAPK1MAPTKMT2A
SCHEMBL28395338 0.80 GABRA1 (0.49) ELANEALDH1A1MAPK1MAPTKMT2A
Water SCHEMBL28566474 0.80 GABRA1 (0.49) ELANEALDH1A1MAPK1MAPTKMT2A

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-0757661-B1 METHOD AND PLANT FOR PRODUCING HYDROGEN PEROXIDE ATOFINA (FR) 2002-08-14 — — EP disclosed
US-6340410-B1 Method for delivering a variable flow of hydrogen peroxide to a bleaching vessel ATOFINA (FR) 2002-01-22 — — US disclosed
US-5902559-A Plant for the production of hydrogen peroxide CHEMOXAL SA (FR) 1999-05-11 — — US disclosed
EP-0757661-A1 METHOD AND PLANT FOR PRODUCING HYDROGEN PEROXIDE Atofina (FR) 1997-02-12 — — EP disclosed
WO-1996026896-A1 METHOD AND PLANT FOR PRODUCING HYDROGEN PEROXIDE CHEMOXAL S.A. (FR) 1996-09-06 — — WO disclosed
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