SCHEMBL9452989

SCHEMBL9452989

CC(=O)O[C@@H]1[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@](CO)(C(C)=O)O[C@@H]1Cl

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.32

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
SCHEMBL11393710 0.84 ASGR1 (0.32)
SCHEMBL812463 0.83 ABCB1 (0.31) ABCB1
SCHEMBL3207681 0.83 OGA (0.34)
SCHEMBL813499 0.82
SCHEMBL11669546 0.81 OGA (0.32) ABCB1
SCHEMBL3547731 0.81 OGA (0.32) ABCB1
SCHEMBL8533169 0.81 OGA (0.32) ABCB1
SCHEMBL11401381 0.78 ASGR1 (0.36)
SCHEMBL14312202 0.78 ABCB1 (0.32) ABCB1
SCHEMBL17004686 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5218097-A PROCESS FOR THE PREPARATION OF PROTECTED MONO-SUGAR AND OLIGO-SUGAR HALIDES CIBA-GEIGY CORPORATION (US) 1993-06-08 US disclosed