SCHEMBL6650591

SCHEMBL6650591

O[C@H]1[C@H](O)CCO[C@@H]1COC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TYMP P19971 15/20 0.39
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KIF11 P52732 1/20 0.36
SLC6A1 P30531 1/20 0.34
GBA1 P04062 1/20 0.31

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
SCHEMBL5930460 0.85 TYMP (0.40) TYMPMEN1KMT2AKIF11
SCHEMBL9025529 0.85 TYMP (0.40) TYMPMEN1KMT2AKIF11
SCHEMBL31138990 0.82 TYMP (0.42) TYMPMEN1KMT2AKIF11
SCHEMBL13690826 0.82 TYMP (0.44) TYMPMEN1KMT2AKIF11SLC6A1
SCHEMBL283757 0.82 TYMP (0.44) TYMPMEN1KMT2AKIF11SLC6A1
SCHEMBL23215181 0.82 TYMP (0.44) TYMPMEN1KMT2AKIF11SLC6A1
SCHEMBL6650282 0.77 KIF11 (0.39) TYMPMEN1KMT2AKIF11SLC6A1
SCHEMBL5443832 0.77 TYMP (0.52) TYMPMEN1KMT2AKIF11
SCHEMBL5438423 0.77 TYMP (0.52) TYMPMEN1KMT2AKIF11
SCHEMBL10408396 0.77 TYMP (0.52) TYMPMEN1KMT2AKIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0741731-B1 PROCESS FOR EPOXIDISING PROCHIRAL OLEFINS SMITHKLINE BEECHAM PLC (GB) 2004-04-07 EP disclosed
US-5916975-A Process for epoxidising prochiral olefins and a catalyst therefor and intermediates for making the catalyst SMITHKLINE BEECHAM P.L.C. (GB) 1999-06-29 US disclosed
US-5616750-A Compounds and process SMITHKLINE BEECHAM PLC (GB) 1997-04-01 US disclosed
EP-0741731-A1 PROCESS FOR EPOXIDISING PROCHIRAL OLEFINS AND A CATALYST THEREFOR AND INTERMEDIATES FOR MAKING THE CATALYST SMITHKLINE BEECHAM PLC (GB) 1996-11-13 EP disclosed
EP-0655950-B1 CHIRAL CATALYSTS AND EPOXIDATION REACTIONS CATALYZED THEREBY SMITHKLINE BEECHAM PLC (GB) 1996-10-23 EP disclosed
WO-1995021172-A1 PROCESS FOR EPOXIDISING PROCHIRAL OLEFINS AND A CATALYST THEREFOR AND INTERMEDIATES FOR MAKING THE CATALYST SMITHKLINE BEECHAM P.L.C. (GB) 1995-08-10 WO disclosed
EP-0655950-A1 CHIRAL CATALYSTS AND EPOXIDATION REACTIONS CATALYZED THEREBY. SMITHKLINE BEECHAM PLC (GB) 1995-06-07 EP disclosed
WO-1994003271-A1 CHIRAL CATALYSTS AND EPOXIDATION REACTIONS CATALYZED THEREBY SMITHKLINE BEECHAM PLC (GB) 1994-02-17 WO disclosed