SCHEMBL30689397

SCHEMBL30689397

C=C(Cc1nc(-c2ccc(Oc3ccc(F)cn3)cc2F)no1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AKR1B1 P15121 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ PPARG P37231 1/20 0.38
▸ HTT P42858 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ S1PR1 P21453 1/20 0.38
▸ S1PR3 Q99500 1/20 0.38
▸ SCN9A Q15858 2/20 0.37
▸ HDAC1 Q13547 2/20 0.37
▸ HDAC8 Q9BY41 2/20 0.37
▸ HDAC6 Q9UBN7 2/20 0.37
▸ HDAC5 Q9UQL6 2/20 0.37
▸ SCN7A Q01118 1/20 0.37

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 0.87 MAPT (0.42) AKR1B1MAPTPPARGHTTSMN1; SMN2
SCHEMBL30689442 0.82 GSTP1 (0.41) PPARGKMT2ASCN9ASCN7AKCNH2
SCHEMBL30689425 0.81 MAPT (0.42) AKR1B1MAPTPPARGHTTSMN1; SMN2
SCHEMBL30689359 0.76 IP6K1 (0.39) MAPTPPARGHTTSMN1; SMN2ALDH1A1
SCHEMBL31527956 0.76 GSTP1 (0.43) MAPTPPARGHTTSMN1; SMN2SCN7A
SCHEMBL31527877 0.76 GSTP1 (0.44) PPARGSMN1; SMN2S1PR1SCN7AKCNH2
SCHEMBL30689305 0.75 IP6K1 (0.38) MAPTPPARGHTTSMN1; SMN2ALDH1A1
SCHEMBL30689401 0.75 DRD1 (0.44) AKR1B1MAPTPPARGHTTSMN1; SMN2
SCHEMBL30689307 0.75 LTA4H (0.52) MAPTLMNAKCNH2GSTP1FFAR1
SCHEMBL30689313 0.75 CNR2 (0.40) GSTP1FFAR1CNR2CNR1

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 4 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
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 disclosed
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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