SCHEMBL24200084

SCHEMBL24200084

CCOC(=O)Cc1ccccc1OC(/C=C/c1cccc(CN)c1)CC

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 4/20 0.44
▸ PLAU P00749 2/20 0.39
▸ F11 P03951 2/20 0.39
▸ TPSB2 P20231 2/20 0.39
▸ PLG P00747 1/20 0.39
▸ KLKB1 P03952 1/20 0.39
▸ F7 P08709 1/20 0.39
▸ TBXAS1 P24557 1/20 0.36
▸ F10 P00742 2/20 0.35
▸ DPP4 P27487 2/20 0.34
▸ AKR1C3 P42330 2/20 0.34
▸ CYP4F2 P78329 1/20 0.34
▸ CYP4A11 Q02928 1/20 0.34
▸ PKM P14618 1/20 0.34
▸ F2 P00734 1/20 0.33
▸ AKR1C2 P52895 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33

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
SCHEMBL21455128 0.90 CFD (0.50) CFDPLAUF11TPSB2PLG
SCHEMBL21455691 0.78 TBXAS1 (0.42) TBXAS1CYP4F2CYP4A11PKMMEN1
SCHEMBL21455759 0.73 L3MBTL1 (0.40) CFDTBXAS1DPP4PKMMEN1
SCHEMBL23617310 0.73 L3MBTL1 (0.40) CFDTBXAS1DPP4PKMMEN1
SCHEMBL21455427 0.73 TBXAS1 (0.42) CFDTBXAS1CYP4F2CYP4A11PKM
SCHEMBL28736136 0.72 CFD (0.73) CFDPLAUF11TPSB2PLG
SCHEMBL29592574 0.72 CFD (0.73) CFDPLAUF11TPSB2PLG
SCHEMBL21455544 0.71 TBXAS1 (0.37) TBXAS1CYP4F2CYP4A11PKMMEN1
SCHEMBL23229004 0.70 TBXAS1 (0.47) TBXAS1CYP4F2CYP4A11PKM
SCHEMBL23241478 0.70 TBXAS1 (0.47) TBXAS1CYP4F2CYP4A11PKMMEN1

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
EP-3939658-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS Biocryst Pharmaceuticals, Inc. (US) 2022-01-19 — — EP disclosed
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