SCHEMBL8536612

SCHEMBL8536612

Oc1ccc2cc(-c3cc(-c4ccc5cc(O)ccc5c4)cc(-c4ccc5cc(O)ccc5c4)c3)ccc2c1

nearest known ligand 0.82

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.82
ABCB1 P08183 2/20 0.82
BCR P11274 2/20 0.82
ESR1 P03372 14/20 0.81
ESR2 Q92731 14/20 0.81
HSD17B1 P14061 2/20 0.71
CYP1A2 P05177 1/20 0.71
CYP3A4 P08684 1/20 0.71
CYP2D6 P10635 1/20 0.71
CYP2C9 P11712 1/20 0.71
CYP2B6 P20813 1/20 0.71
CYP2C19 P33261 1/20 0.71
HSD17B2 P37059 1/20 0.71

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
SCHEMBL3014459 0.95 ABL1 (0.91) ABL1ABCB1BCRESR1ESR2
SCHEMBL30275026 0.95 ESR2 (0.90) ABL1ABCB1BCRESR1ESR2
SCHEMBL5425451 0.95 ESR2 (0.90) ABL1ABCB1BCRESR1ESR2
SCHEMBL3016969 0.91 ABL1 (0.83) ABL1ABCB1BCRESR1ESR2
SCHEMBL1741908 0.90 ABL1 (1.00) ABL1ABCB1BCRESR1ESR2
SCHEMBL21729891 0.90 ESR1 (0.87) ABL1ABCB1BCRESR1ESR2
SCHEMBL29991899 0.90 ESR1 (1.00) ABL1ABCB1BCRESR1ESR2
SCHEMBL2699234 0.90 ESR1 (1.00) ABL1ABCB1BCRESR1ESR2
Methane SCHEMBL5526746 0.87 ESR1 (0.95) ABL1ABCB1BCRESR1ESR2
SCHEMBL516421 0.86 ESR1 (0.90) ABL1ABCB1BCRESR1ESR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2841471-B1 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSTS GRACE W R & CO (US) 2020-05-06 EP disclosed
US-20190153135-A1 Activator Compositions, Their Preparation, And Their Use In Catalysts GRACE W R & CO (US) 2019-05-23 US disclosed
US-10221264-B2 Activator compositions, their preparation, and their use in catalysts W. R. GRACE & CO.-CONN. (US) 2019-03-05 US disclosed
CN-103380154-B Activator composition, its preparation and the purposes in catalysis thereof 阿尔比马尔公司 2016-08-24 CN disclosed
CN-104854150-A Activator compositions, their preparation, and their use in catalysts ALBEMARLE CORP 2015-08-19 CN disclosed
US-20150105238-A1 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSTS W. R. GRACE & CO.-CONN. 2015-04-16 US disclosed
EP-2643366-B1 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSIS ALBEMARLE CORP (US) 2015-03-25 EP disclosed
EP-2841471-A1 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSTS Albemarle Corporation (US) 2015-03-04 EP disclosed
US-8895465-B2 Activator compositions, their preparation, and their use in catalysis ALBEMARLE CORPORATION (US) 2014-11-25 US disclosed
WO-2013162745-A1 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSTS ALBEMARLE CORPORATION (US) 2013-10-31 WO disclosed
EP-2643366-A2 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSIS Albemarle Corporation (US) 2013-10-02 EP disclosed
US-20130253155-A1 Activator Compositions, Their Preparation, and Their Use In Catalysis ALBEMARIE CORPORATION (US) 2013-09-26 US disclosed
WO-2012071205-A2 ACTIVATOR COMPOSITIONS, THEIR PREPARATION, AND THEIR USE IN CATALYSIS ALBEMARLE CORPORATION (US) 2012-05-31 WO disclosed