SCHEMBL7823178

SCHEMBL7823178

COc1cccc(P(=O)(Oc2ccccc2)Oc2ccccc2)c1-c1c(OC)cccc1P(=O)(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.47
TDP1 Q9NUW8 1/20 0.47
LMNA P02545 1/20 0.45
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HTT P42858 2/20 0.41
PKM P14618 1/20 0.41
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
SRC P12931 1/20 0.40
CA12 O43570 3/20 0.39
CA1 P00915 3/20 0.39
CA2 P00918 3/20 0.39
CA7 P43166 3/20 0.39
CA9 Q16790 3/20 0.39
CA4 P22748 3/20 0.39
CA14 Q9ULX7 2/20 0.39
HCRTR1 O43613 1/20 0.39
HPGD P15428 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL8908268 0.84 L3MBTL1 (0.44) L3MBTL1TDP1LMNAMEN1KMT2A
SCHEMBL9079781 0.83 L3MBTL1 (0.41) L3MBTL1TDP1LMNAMEN1KMT2A
SCHEMBL14810055 0.81 L3MBTL1 (0.48) L3MBTL1TDP1LMNAMEN1KMT2A
SCHEMBL8966725 0.79 L3MBTL1 (0.50) L3MBTL1TDP1LMNAMEN1KMT2A
SCHEMBL30523872 0.78 L3MBTL1 (0.67) L3MBTL1TDP1LMNAMEN1KMT2A
SCHEMBL14810747 0.76 MEN1 (0.47) L3MBTL1TDP1LMNAMEN1KMT2A
SCHEMBL5715738 0.76 KMT2A (0.51) L3MBTL1TDP1MEN1KMT2AHTT
SCHEMBL18030236 0.75 MEN1 (0.49) L3MBTL1MEN1KMT2AHTTPOLB
SCHEMBL3890511 0.73 L3MBTL1 (0.55) L3MBTL1TDP1LMNAMEN1KMT2A
SCHEMBL30598260 0.73 L3MBTL1 (0.55) L3MBTL1TDP1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0530335-B1 DIPHOSPHONIC ACID DERIVATES AS INTERMEDIATES FOR THE PRODUCTION OF DIPHOSPHINE LIGANDS HOFFMANN LA ROCHE (CH) 1996-08-14 EP claimed
US-5302738-A Chiral phosphines HOFFMANN-LA ROCHE INC. (US) 1994-04-12 US claimed
EP-0570764-B1 Asymmetric hydrogenation HOFFMANN LA ROCHE (CH) 2001-07-18 EP disclosed
EP-0579797-B1 DIPHOSPHINE LIGANDS HOFFMANN LA ROCHE (CH) 1999-04-21 EP disclosed
US-5750690-A HYDROGENATION OF A 1,2-DIALKYLOXO-3-CARBOXY-3-PYRAZOLINE OR 1,2,5,6-TETRAHYDROPYRIDAZINE OR DERIVATIVE; INTERMEDIATES FOR THE HYPOTENSIVE AGENT, ?CILAZAPRIL? HOFFMANN-LA ROCHE INC. (US) 1998-05-12 US disclosed
US-5600015-A USING RUTHENIUM COMPLEX OF OPTICALLY ACTIVE ATROPISOMERIC DIPHOSPHINE LIGAND AS HYDROGENATION CATALYST HOFFMANN-LA ROCHE INC. (US) 1997-02-04 US disclosed
EP-0565975-B1 Process for the preparation of isoprenoid derivatives HOFFMANN LA ROCHE (CH) 1996-09-04 EP disclosed
EP-0530335-B1 DIPHOSPHONIC ACID DERIVATES AS INTERMEDIATES FOR THE PRODUCTION OF DIPHOSPHINE LIGANDS HOFFMANN LA ROCHE (CH) 1996-08-14 EP disclosed
EP-0530336-B1 CHIRAL PHOSPHINES HOFFMANN LA ROCHE (CH) 1996-03-06 EP disclosed
US-5457219-A Used in making hydrogenation catalysts and isomerization catalysts HOFFMANN-LA ROCHE INC. (US) 1995-10-10 US disclosed
US-5302738-A Chiral phosphines HOFFMANN-LA ROCHE INC. (US) 1994-04-12 US disclosed
US-5274125-A Chirale phosphines HOFFMANN-LA ROCHE INC. (US) 1993-12-28 US disclosed
EP-0570764-A2 Asymmetric hydrogenation F.HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) 1993-11-24 EP disclosed
EP-0565975-A2 Process for the preparation of isoprenoid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1993-10-20 EP disclosed
EP-0530335-A1 DIPHOSPHONIC ACID DERIVATES AS INTERMEDIATES FOR THE PRODUCTION OF DIPHOSPHINE LIGANDS. HOFFMANN LA ROCHE (CH) 1993-03-10 EP disclosed
EP-0530336-A1 CHIRAL PHOSPHINES. HOFFMANN LA ROCHE (CH) 1993-03-10 EP disclosed
WO-1992016536-A1 CHIRAL PHOSPHINES F. HOFFMANN-LA ROCHE AG (CH) 1992-10-01 WO disclosed
WO-1992016535-A1 DIPHOSPHONIC ACID DERIVATES AS INTERMEDIATES FOR THE PRODUCTION OF DIPHOSPHINE LIGANDS F.HOFFMANN-LA ROCHE AG (CH) 1992-10-01 WO disclosed