SCHEMBL23229004

SCHEMBL23229004

CCOC(=O)Cc1ccccc1OC(C)N

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TBXAS1 P24557 1/20 0.47
▸ PKM P14618 1/20 0.46
▸ CYP4F2 P78329 2/20 0.43
▸ CYP4A11 Q02928 2/20 0.43
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.38
▸ USP2 O75604 1/20 0.38
▸ PTPN1 P18031 1/20 0.38

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
SCHEMBL7888801 0.88 TBXAS1 (0.49) TBXAS1PKMCYP4F2CYP4A11SMN1; SMN2
SCHEMBL23229153 0.87 TBXAS1 (0.48) TBXAS1PKMCYP4F2CYP4A11SMN1; SMN2
SCHEMBL23241478 0.85 TBXAS1 (0.47) TBXAS1PKMCYP4F2CYP4A11SMN1; SMN2
SCHEMBL23617253 0.85 TBXAS1 (0.47) TBXAS1PKMCYP4F2CYP4A11SMN1; SMN2
SCHEMBL23425588 0.85 TBXAS1 (0.47) TBXAS1PKMCYP4F2CYP4A11SMN1; SMN2
SCHEMBL21455709 0.84 TBXAS1 (0.46) TBXAS1PKMCYP4F2CYP4A11SMN1; SMN2
SCHEMBL909198 0.84 TBXAS1 (0.48) TBXAS1PKMCYP4F2CYP4A11SMN1; SMN2
SCHEMBL23616962 0.83 TBXAS1 (0.46) TBXAS1PKMCYP4F2CYP4A11SMN1; SMN2
SCHEMBL23229163 0.82 TBXAS1 (0.45) TBXAS1PKMCYP4F2CYP4A11SMN1; SMN2
SCHEMBL21455682 0.81 TBXAS1 (0.44) TBXAS1PKMCYP4F2CYP4A11SMN1; SMN2

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-2021072198-A1 ORAL COMPLEMENT FACTOR D INHIBITORS BIOCRYST PHARMACEUTICALS, INC. (US) 2021-04-15 — — WO disclosed
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