SCHEMBL8946366

SCHEMBL8946366

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

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 2/20 0.53
▸ POLB P06746 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ PTPN1 P18031 4/20 0.48
▸ CA1 P00915 2/20 0.48
▸ CA2 P00918 2/20 0.48
▸ CA9 Q16790 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.44
▸ LGALS9 O00182 1/20 0.43
▸ LGALS1 P09382 1/20 0.43
▸ LGALS3 P17931 1/20 0.43
▸ LGALS7; LGALS7B P47929 1/20 0.43
▸ GAPDH P04406 2/20 0.43
▸ PTPN2 P17706 1/20 0.43
▸ PTPN11 Q06124 1/20 0.43
▸ F11 P03951 2/20 0.42
▸ ELANE P08246 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ MAPK1 P28482 2/20 0.41

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
SCHEMBL26358941 0.90 USP2 (0.51) USP2POLBMEN1KMT2APTPN1
SCHEMBL6402165 0.90 USP2 (0.51) USP2POLBMEN1KMT2APTPN1
SCHEMBL6399736 0.89 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL17975737 0.89 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL4732553 0.89 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL2418301 0.89 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL11438817 0.87 USP2 (0.53) USP2POLBMEN1KMT2APTPN1
SCHEMBL20786060 0.84 USP2 (0.57) USP2POLBMEN1KMT2APTPN1
SCHEMBL9771282 0.84 USP2 (0.55) USP2POLBMEN1KMT2APTPN1
SCHEMBL14405371 0.83 USP2 (0.54) USP2POLBMEN1KMT2APTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5543510-A 2,3,5-TRI-O-PROTECTING GROUP SUBSTITUTED-1-BROMO-B-RIBOFURANOSYL AMIDE ENANTIOMORPHS FOR STEREOSPECIFIC PRODUCTION OF HERBICIDE AMERICAN CYANAMID COMPANY (US) 1996-08-06 — — US disclosed
EP-0649847-A2 Process and intermediates for the preparation of (+)- hydantocidin and analogs thereof AMERICAN CYANAMID COMPANY (US) 1995-04-26 — — EP disclosed
US-5354868-A Hydration, bromination of heterocyclic nitrile, followed by cyclization with silver cyanate or thiocyanate; herbicides AMERICAN CYANAMID COMPANY (US) 1994-10-11 — — US disclosed
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