SCHEMBL8658236

SCHEMBL8658236

CO[C@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](O)[C@H](O)[C@H]1OC(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LGALS3 P17931 3/20 0.46
▸ LGALS9 O00182 2/20 0.46
▸ LGALS1 P09382 2/20 0.46
▸ LGALS7; LGALS7B P47929 2/20 0.46
▸ PTPN1 P18031 3/20 0.46
▸ LGALS4 P56470 1/20 0.46
▸ MEN1 O00255 1/20 0.45
▸ USP2 O75604 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ SYNJ2 O15056 3/20 0.45
▸ ALDH1A1 P00352 3/20 0.45
▸ HTT P42858 1/20 0.43
▸ SLC22A1 O15245 1/20 0.43
▸ TYMP P19971 1/20 0.43
▸ LGALS8 O00214 1/20 0.43
▸ SELP P16109 2/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL12595600 0.93 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL9545439 0.93 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL976416 0.93 PTPN1 (0.48) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL1682180 0.93 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL14413230 0.93 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL24192986 0.93 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL1521368 0.93 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL19869143 0.93 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL12807943 0.93 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1
SCHEMBL1682156 0.93 LGALS3 (0.52) LGALS3LGALS9LGALS1LGALS7; LGALS7BPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0739333-B1 SELECTIVE ASYMMETRIC HYDROGENATION OF DEHYDROAMINO ACID DERIVATIVES USING RHODIUM AND IRIDIUM DIPHOSPHINITE CARBOHYDRATE CATALYST COMPOSITIONS DU PONT (US) 1998-10-14 — — EP disclosed
EP-0739333-A1 SELECTIVE ASYMMETRIC HYDROGENATION OF DEHYDROAMINO ACID DERIVATIVES USING RHODIUM AND IRIDIUM DIPHOSPHINITE CARBOHYDRATE CATALYST COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1996-10-30 — — EP disclosed
US-5510507-A COORDINATION CATALYSTS; EFFICIENT ENANTIOSELECTIVITY E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-04-23 — — US disclosed
US-5481006-A PREPARATION OF INTERMEDIATES FOR PHARMACEUTICALS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-01-02 — — US disclosed
WO-1995018787-A1 SELECTIVE ASYMMETRIC HYDROGENATION OF DEHYDROAMINO ACID DERIVATIVES USING RHODIUM AND IRIDIUM DIPHOSPHINITE CARBOHYDRATE CATALYST COMPOSITIONS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1995-07-13 — — WO disclosed
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