SCHEMBL10478941

SCHEMBL10478941

CC(=O)NO[C@H]1[C@@H]([C@H]2COC(C)(C)O2)OC2OC(C)(C)O[C@@H]21

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CA2 P00918 11/20 0.64
▸ CA1 P00915 7/20 0.64
▸ CA9 Q16790 4/20 0.64
▸ CA12 O43570 2/20 0.34
▸ CA4 P22748 2/20 0.34
▸ CA5A P35218 2/20 0.34
▸ CA7 P43166 2/20 0.34
▸ CA14 Q9ULX7 2/20 0.34
▸ CA5B Q9Y2D0 2/20 0.34
▸ CA6 P23280 1/20 0.34
▸ CA13 Q8N1Q1 1/20 0.34
▸ MAPT P10636 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
SCHEMBL15254185 0.88 CA2 (0.64) CA2CA1CA9CA12CA4
SCHEMBL14441192 0.83 CA2 (0.64) CA2CA1CA9CA12CA4
SCHEMBL1847432 0.83 CA2 (0.64) CA2CA1CA9CA12CA4
SCHEMBL16307847 0.83 CA2 (0.64) CA2CA1CA9CA12CA4
SCHEMBL10883648 0.83 CA2 (0.64) CA2CA1CA9CA12CA4
SCHEMBL15254186 0.82 CA2 (0.63) CA2CA1CA9CA12CA4
SCHEMBL15254188 0.82 CA2 (0.63) CA2CA1CA9CA12CA4
SCHEMBL11520537 0.80 CA2 (0.58) CA2CA1CA9CA12CA4
SCHEMBL2672023 0.80 CA2 (0.60) CA2CA1CA9CA12CA4
SCHEMBL12408846 0.79 CA2 (0.67) CA2CA1CA9CA12CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE33000-E AMINOMONOSACCHARIDE DERIVATIVE GREENWICH PHARMACEUTICALS, INCORPORATED (US) 1989-07-25 — — US disclosed
US-RE30379-E ANTIVIRAL ACTIVITY STRATEGIC MEDICAL RESEARCH CORP. (US) 1980-08-19 — — US disclosed
US-4056322-A Preparation of ethers of monosaccharides STRATEGIC MEDICAL RESEARCH CORPORATION (US) 1977-11-01 — — US disclosed
US-4017608-A VIRICIDES STRATEGIC MEDICAL RESEARCH CORPORATION (US) 1977-04-12 — — US disclosed
US-3965262-A OR MEMORY IN WARM BLOODED ANIMALSMONOSACCHARIDE DERIVATIVES STRATEGIC MEDICAL RESEARCH CORPORATION (US) 1976-06-22 — — US disclosed
US-3939146-A VIRICIDE STRATEGIC MEDICAL RESEARCH CORPORATION (US) 1976-02-17 — — US disclosed
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