SCHEMBL17656774

SCHEMBL17656774

COc1cc(O)c2c(c1)OC(c1ccccc1O)CC2=O

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 2/20 0.76
▸ CYP19A1 P11511 3/20 0.70
▸ ALDH1A1 P00352 2/20 0.70
▸ ADORA3 P0DMS8 2/20 0.70
▸ MAPT P10636 1/20 0.70
▸ ATM Q13315 1/20 0.70
▸ TDP1 Q9NUW8 1/20 0.70
▸ TAS2R31 P59538 1/20 0.70
▸ CYP1A1 P04798 2/20 0.62
▸ CYP1A2 P05177 2/20 0.62
▸ CYP1B1 Q16678 2/20 0.62
▸ PTGS1 P23219 1/20 0.58
▸ PTGS2 P35354 1/20 0.58
▸ TYR P14679 1/20 0.58
▸ CYP3A4 P08684 2/20 0.57
▸ AR P10275 2/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ HPGD P15428 1/20 0.57
▸ MAPK1 P28482 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57

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
Artocarpanone SCHEMBL29649131 0.88 CYP19A1 (0.77) ABCG2CYP19A1ALDH1A1ADORA3MAPT
Artocarpanone SCHEMBL17656773 0.88 CYP19A1 (0.77) ABCG2CYP19A1ALDH1A1ADORA3MAPT
Pinostrobin SCHEMBL7648566 0.86 ABCG2 (1.00) ABCG2CYP19A1ALDH1A1ADORA3MAPT
Pinostrobin SCHEMBL31264673 0.86 ABCG2 (1.00) ABCG2CYP19A1ALDH1A1ADORA3MAPT
Pinostrobin SCHEMBL30238575 0.86 ABCG2 (1.00) ABCG2CYP19A1ALDH1A1ADORA3MAPT
Pinostrobin SCHEMBL1485747 0.86 ABCG2 (1.00) ABCG2CYP19A1ALDH1A1ADORA3MAPT
SCHEMBL29650043 0.86 CYP19A1 (0.78) CYP19A1ALDH1A1ADORA3MAPTTDP1
SCHEMBL27920300 0.83 CYP19A1 (0.77) ABCG2CYP19A1ALDH1A1ADORA3MAPT
Sakuranetin SCHEMBL555541 0.82 CYP19A1 (1.00) ABCG2CYP19A1ALDH1A1ADORA3MAPT
Sakuranetin SCHEMBL555542 0.82 CYP19A1 (1.00) ABCG2CYP19A1ALDH1A1ADORA3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10435673-B2 Method for the biotechnological production of flavonoids SYMRISE AG (DE) 2019-10-08 — — US disclosed
US-20180135029-A1 METHOD FOR THE BIOTECHNOLOGICAL PRODUCTION OF FLAVONOIDS SYMRISE AG (DE) 2018-05-17 — — US disclosed
US-20180135029-A1 METHOD FOR THE BIOTECHNOLOGICAL PRODUCTION OF FLAVONOIDS SYMRISE AG (DE) 2018-05-17 — — US disclosed
EP-3002335-A1 Process for the biotechnological production of flavonoids Symrise AG (DE) 2016-04-06 — — EP disclosed
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