SCHEMBL6575792

SCHEMBL6575792

O=C1Cc2ccccc2OC1c1ccc(O)c(O)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.44
PTGS2 P35354 1/20 0.44
KDM4E B2RXH2 4/20 0.42
MAPT P10636 4/20 0.42
RECQL P46063 4/20 0.42
CYP19A1 P11511 3/20 0.42
POLB P06746 3/20 0.42
GAA P10253 3/20 0.42
CYP3A4 P08684 3/20 0.42
ALOX15 P16050 3/20 0.42
MAPK1 P28482 3/20 0.42
HSD17B10 Q99714 3/20 0.42
ALPI P09923 2/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 2/20 0.42
CA12 O43570 1/20 0.42
SLCO2B1 O94956 1/20 0.42
CYP1A1 P04798 1/20 0.42
CA4 P22748 1/20 0.42
PSMB5 P28074 1/20 0.42

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
SCHEMBL3696621 0.84 KDM4E (0.54) PTGS2KDM4EMAPTRECQLCYP19A1
SCHEMBL5084443 0.84 MEN1 (0.49) ALOX5CYP19A1POLBGAACYP3A4
SCHEMBL27183319 0.84 CYP19A1 (0.48) PTGS2MAPTCYP19A1CYP3A4MAPK1
SCHEMBL2283832 0.84 CYP3A4 (0.49) KDM4EMAPTCYP19A1CYP3A4MAPK1
SCHEMBL5088610 0.83 CYP19A1 (0.47) MAPTCYP19A1CYP3A4MAPK1HSD17B10
SCHEMBL21518315 0.82 CYP19A1 (0.39) MAPTRECQLCYP19A1CYP3A4MAPK1
SCHEMBL11264764 0.81 GSK3B (0.44) KDM4ECYP3A4
SCHEMBL19746 0.80 CYP19A1 (0.45) KDM4EMAPTCYP19A1POLBGAA
SCHEMBL11733122 0.79 CYP19A1 (0.44) KDM4EMAPTCYP19A1POLBGAA
Methane SCHEMBL27973705 0.79 CYP19A1 (0.44) KDM4EMAPTCYP19A1POLBGAA

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-1436371-A2 ENZYMATIC SYSTEMS FOR GENERATING ACTIVE OXYGEN SPECIES FOR REACTING WITH OTHER PRECURSORS TO OBTAIN OXIDATION AND/OR BLEACHING Call, Krimhild (DE) 2004-07-14 EP disclosed
WO-2002099023-A2 ENZYMATIC SYSTEMS FOR GENERATING ACTIVE OXYGEN SPECIES FOR REACTING WITH OTHER PRECURSORS TO OBTAIN OXIDATION AND/OR BLEACHING CALL, KRIMHILD (DE) 2002-12-12 WO disclosed
EP-1012376-A2 OXIDATION AND BLEACHING SYSTEM WITH ENZYMATICALLY PRODUCED OXIDIZING AGENTS Blume, Hildegard (DE) 2000-06-28 EP disclosed
WO-1999001607-A2 ENZYMATIC OXIDATION SYSTEM WITH NOVEL ENZYMATIC-EFFECT ENHANCING COMPOUNDS CALL, KRIMHILD (DE) 1999-01-14 WO disclosed
WO-1998059108-A2 OXIDATION AND BLEACHING SYSTEM WITH ENZYMATICALLY PRODUCED OXIDIZING AGENTS BLUME, HILDEGARD (DE) 1998-12-30 WO disclosed
CN-86104085-A The preparation method of Thiazolidinecarboxylacid acid derivatives 1987-04-22 CN disclosed