SCHEMBL16729464

SCHEMBL16729464

C[C@H](O)[C@H](C)OC(CO)[C@@H](O)CO

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.35
LMNA P02545 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TSHR P16473 1/20 0.30

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
SCHEMBL14959561 1.00 TDP1 (0.35) TDP1LMNAL3MBTL1TSHR
SCHEMBL10200778 1.00 TDP1 (0.35) TDP1LMNAL3MBTL1TSHR
SCHEMBL2600227 1.00 TDP1 (0.35) TDP1LMNAL3MBTL1TSHR
SCHEMBL15267652 0.86 TSHR (0.33) TDP1LMNATSHR
SCHEMBL14839145 0.86 TDP1 (0.35) TDP1LMNAL3MBTL1TSHR
SCHEMBL18221666 0.86 TDP1 (0.35) TDP1LMNAL3MBTL1TSHR
SCHEMBL13512903 0.86 TDP1 (0.35) TDP1LMNAL3MBTL1TSHR
SCHEMBL16729400 0.85 TDP1 (0.31) TDP1
SCHEMBL19277005 0.81 TDP1 (0.35) TDP1LMNAL3MBTL1TSHR
SCHEMBL18934170 0.81 TDP1 (0.35) TDP1LMNAL3MBTL1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9469864-B2 Reversible natural product glycosyltransferase-catalyzed reactions, compounds and related methods WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2016-10-18 US disclosed
US-20150141294-A1 REVERSIBLE NATURAL PRODUCT GLYCOSYLTRANSFERASE-CATALYZED REACTIONS, COMPOUNDS AND RELATED METHODS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-05-21 US disclosed