SCHEMBL23678482

SCHEMBL23678482

CCCCOc1ccc(F)c(C(CC(=N)OC(C)=N)OC(N)=O)c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 2/20 0.38
▸ FFAR4 Q5NUL3 1/20 0.38
▸ MCL1 Q07820 1/20 0.37
▸ LMNA P02545 1/20 0.35
▸ MMP9 P14780 1/20 0.35
▸ MMP8 P22894 1/20 0.35
▸ MMP13 P45452 1/20 0.35
▸ SPHK1 Q9NYA1 2/20 0.35
▸ CNR2 P34972 2/20 0.34
▸ RARA P10276 1/20 0.34
▸ RARB P10826 1/20 0.34
▸ S1PR4 O95977 1/20 0.34
▸ S1PR1 P21453 1/20 0.34
▸ S1PR3 Q99500 1/20 0.34
▸ S1PR5 Q9H228 1/20 0.34
▸ CRBN Q96SW2 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ FAAH O00519 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
SCHEMBL23678379 0.90 KDM4E (0.38) FFAR1FFAR4LMNA
SCHEMBL23678480 0.90 MAOB (0.36) FFAR1FFAR4
SCHEMBL23678389 0.87 CYP2C9 (0.36) FFAR1LMNAHTT
SCHEMBL23678459 0.84 SPHK2 (0.38) SPHK1RARARARBS1PR1
SCHEMBL23678450 0.83 FFAR1 (0.31) FFAR1
SCHEMBL23678320 0.81 MCL1 (0.37) FFAR1FFAR4MCL1CNR2RARA
SCHEMBL23678416 0.79 MAOB (0.35) FFAR1FFAR4
SCHEMBL23678245 0.79 CTSA (0.32) FFAR1LMNA
SCHEMBL23678335 0.77 KLKB1 (0.31) —
SCHEMBL23678478 0.76 KIF11 (0.39) FFAR1

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
Send feedback