SCHEMBL30689359

SCHEMBL30689359

C=C(Cc1nc(-c2c(F)cc(Oc3ccccn3)cc2F)no1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IP6K1 Q92551 2/20 0.39
▸ IP6K3 Q96PC2 2/20 0.39
▸ IP6K2 Q9UHH9 2/20 0.39
▸ FFAR4 Q5NUL3 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ SMN1; SMN2 Q16637 5/20 0.36
▸ NPC1 O15118 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ SCN7A Q01118 4/20 0.36
▸ KCNH2 Q12809 4/20 0.36
▸ GSTP1 P09211 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL31527931 0.89 MAPT (0.42) IP6K1IP6K3IP6K2TP53SMN1; SMN2
SCHEMBL30689352 0.86 PPARG (0.38) TP53SMN1; SMN2ALDH1A1KCNH2GSTP1
SCHEMBL30689409 0.85 FFAR4 (0.41) IP6K1IP6K3IP6K2FFAR4TP53
SCHEMBL30689347 0.85 IP6K1 (0.48) IP6K1IP6K3IP6K2TP53SMN1; SMN2
SCHEMBL31527938 0.83 GSTP1 (0.39) IP6K1IP6K3IP6K2FFAR4TP53
SCHEMBL30689405 0.83 MAPT (0.36) IP6K1IP6K3IP6K2FFAR4TP53
SCHEMBL31527956 0.82 GSTP1 (0.43) IP6K1IP6K3IP6K2TP53SMN1; SMN2
SCHEMBL31527877 0.82 GSTP1 (0.44) IP6K1IP6K3IP6K2TP53SMN1; SMN2
SCHEMBL30689399 0.81 MAPT (0.39) TP53SMN1; SMN2NPC1ALDH1A1NPSR1
SCHEMBL30689305 0.81 IP6K1 (0.38) IP6K1IP6K3IP6K2SMN1; SMN2NPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119968366-A Oxadiazole derivatives, methods of preparation and use thereof in the treatment of inflammatory diseases 西特瑞治疗有限公司 2025-05-09 — — CN claimed
EP-4543875-A1 OXADIAZOLE DERIVATIVES, PREPARATION PROCESS THEREOF AND THEIR USE IN TREATING INFLAMMATORY DISEASES Sitryx Therapeutics Limited (GB) 2025-04-30 — — EP disclosed
WO-2023247958-A1 OXADIAZOLE DERIVATIVES, PREPARATION PROCESS THEREOF AND THEIR USE IN TREATING INFLAMMATORY DISEASES SITRYX THERAPEUTICS LIMITED (GB) 2023-12-28 — — WO disclosed
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