SCHEMBL9748707

SCHEMBL9748707

O=C(CCc1ccccc1)c1cc(O)ccc1O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.66
GAA P10253 2/20 0.61
MAPT P10636 2/20 0.61
SLC5A1 P13866 2/20 0.61
SLC5A2 P31639 2/20 0.61
CHRNA7 P36544 1/20 0.59
ALOX5 P09917 2/20 0.56
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
PTGS2 P35354 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
CYP1A1 P04798 1/20 0.51
CYP1B1 Q16678 1/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
ABCB1 P08183 3/20 0.50
KDM4E B2RXH2 1/20 0.50

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
SCHEMBL30065457 0.87 GAA (0.66) CYP19A1GAAMAPTSLC5A1SLC5A2
SCHEMBL7301852 0.87 GAA (0.66) CYP19A1GAAMAPTSLC5A1SLC5A2
SCHEMBL6289452 0.84 FFAR1 (0.61) CYP19A1GAAMAPTSLC5A1SLC5A2
SCHEMBL10830275 0.84 MEN1 (0.67) CYP19A1GAAMAPTSLC5A1SLC5A2
SCHEMBL15650343 0.84 RAB9A (0.55) CYP19A1GAAMAPTSLC5A1SLC5A2
SCHEMBL6906879 0.84 CYP19A1 (0.58) CYP19A1GAAMAPTSLC5A1SLC5A2
SCHEMBL9061935 0.83 ESR1 (0.59) GAAMAPTCHRNA7ALOX5CA12
Dihydrochalcone SCHEMBL29359372 0.82 CYP19A1 (0.80) CYP19A1GAAMAPTSLC5A1SLC5A2
Dihydrochalcone SCHEMBL2827303 0.82 CYP19A1 (0.80) CYP19A1GAAMAPTSLC5A1SLC5A2
SCHEMBL9748469 0.82 FFAR1 (0.58) CYP19A1GAAMAPTSLC5A1SLC5A2

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
US-5120874-A Process for the preparation of 5-hydroxydiprafenone and its acid addition salts HELOPHARM W. PETRIK GMBH & CO. KG (DE) 1992-06-09 US claimed
EP-0283540-B1 PROCESS FOR THE PREPARATION OF 5-HYDROXYDIPRAPHENONE AND ITS SALTS WITH ACIDS Helopharm W. Petrik GmbH & Co.KG. (DE) 1991-09-18 EP claimed
EP-0283540-A1 Process for the preparation of 5-hydroxydipraphenone and its salts with acids Helopharm W. Petrik GmbH & Co.KG. (DE) 1988-09-28 EP claimed
US-5120874-A Process for the preparation of 5-hydroxydiprafenone and its acid addition salts HELOPHARM W. PETRIK GMBH & CO. KG (DE) 1992-06-09 US disclosed
EP-0283540-B1 PROCESS FOR THE PREPARATION OF 5-HYDROXYDIPRAPHENONE AND ITS SALTS WITH ACIDS Helopharm W. Petrik GmbH & Co.KG. (DE) 1991-09-18 EP disclosed
EP-0283540-A1 Process for the preparation of 5-hydroxydipraphenone and its salts with acids Helopharm W. Petrik GmbH & Co.KG. (DE) 1988-09-28 EP disclosed