SCHEMBL23678442

SCHEMBL23678442

CC(=N)OC(=N)CC(O)c1cccc(-c2ccc(F)cc2)c1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ AGXT P21549 1/20 0.40
▸ CTSA P10619 1/20 0.39
▸ HSD17B2 P37059 1/20 0.36
▸ FFAR1 O14842 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ PTPN5 P54829 1/20 0.34
▸ F9 P00740 1/20 0.34
▸ RXRA P19793 1/20 0.33
▸ RXRB P28702 1/20 0.33
▸ RXRG P48443 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ ADRB1 P08588 1/20 0.32
▸ ADRB3 P13945 1/20 0.32
▸ MRGPRX4 Q96LA9 1/20 0.32
▸ MGLL Q99685 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
SCHEMBL23678237 0.89 L3MBTL1 (0.33) CTSAHSD17B2FFAR1L3MBTL1PTPN5
SCHEMBL23678263 0.87 CTSA (0.39) CTSAFFAR1L3MBTL1PTPN5F9
SCHEMBL23678326 0.86 AGXT (0.43) AGXTFFAR1PTPN5
SCHEMBL23678327 0.86 AGXT (0.43) AGXTFFAR1PTPN5
SCHEMBL23678375 0.86 AGXT (0.43) AGXTFFAR1PTPN5
SCHEMBL23678432 0.84 F9 (0.47) CTSAPTPN5F9
SCHEMBL23678340 0.83 CTSA (0.38) CTSAFFAR1L3MBTL1ESR2ADRB1
SCHEMBL23678486 0.80 CTSA (0.39) AGXTCTSAHSD17B2FFAR1F9
SCHEMBL23678410 0.78 CTSA (0.41) CTSAFFAR1ADRB1ADRB3
SCHEMBL23678331 0.75 PTPN5 (0.40) AGXTFFAR1PTPN5F9

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-3854788-A1 COMPOUND CONTAINING OXADIAZOLE, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME SK Biopharmaceuticals Co., Ltd. (KR) 2021-07-28 — — EP disclosed
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