SCHEMBL20026953

SCHEMBL20026953

CC1(C)OB(c2cnn(CO[Si](C)(C)C(C)(C)C)c2)OC1(C)C

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.60
DGAT1 O75907 2/20 0.34
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
LPL P06858 3/20 0.32
LIPG Q9Y5X9 3/20 0.32
AAK1 Q2M2I8 1/20 0.32
IRAK4 Q9NWZ3 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
SCHEMBL2512704 0.86 FFAR1 (0.58) FFAR1DGAT1LPLLIPGAAK1
SCHEMBL14788157 0.85 FFAR1 (0.58) FFAR1DGAT1CA1CA2CA9
SCHEMBL14788223 0.84 FFAR1 (0.55) FFAR1DGAT1LPLLIPG
SCHEMBL21092774 0.84 FFAR1 (0.62) FFAR1DGAT1AAK1
SCHEMBL25289998 0.82 FFAR1 (0.53) FFAR1DGAT1LPLLIPG
SCHEMBL1908045 0.81 FFAR1 (0.52) FFAR1DGAT1AAK1
SCHEMBL1869990 0.81 FFAR1 (0.60) FFAR1DGAT1CA1CA2CA9
SCHEMBL24609489 0.78 FFAR1 (0.57) FFAR1DGAT1CA1CA2CA9
SCHEMBL14857496 0.78 FFAR1 (0.78) FFAR1DGAT1LPLLIPGAAK1
SCHEMBL9286866 0.77 FFAR1 (0.53) FFAR1DGAT1AAK1

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
WO-2018064135-A1 P2X3 AND/OR P2X2/3 COMPOUNDS AND METHODS ASANA BIOSCIENCES, LLC (US) 2018-04-05 WO disclosed