SCHEMBL30689399

SCHEMBL30689399

C=C(Cc1nc(-c2cc(F)c(Oc3ccccn3)cc2Cl)no1)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ TP53 P04637 2/20 0.39
▸ TSHR P16473 2/20 0.39
▸ NFKB1 P19838 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ NFKB2 Q00653 2/20 0.39
▸ RELA Q04206 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ S1PR1 P21453 4/20 0.37
▸ CNR2 P34972 3/20 0.37
▸ CNR1 P21554 2/20 0.37
▸ GSTP1 P09211 2/20 0.36
▸ FFAR1 O14842 2/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ ALDH1A1 P00352 4/20 0.35

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
SCHEMBL30689405 0.92 MAPT (0.36) MAPTSMN1; SMN2NPC1TP53TSHR
SCHEMBL31527956 0.84 GSTP1 (0.43) MAPTSMN1; SMN2NPC1TP53TSHR
SCHEMBL31527938 0.84 GSTP1 (0.39) MAPTSMN1; SMN2NPC1TP53TSHR
SCHEMBL31527896 0.83 FFAR1 (0.44) MAPTSMN1; SMN2NPC1TP53TSHR
SCHEMBL31527931 0.83 MAPT (0.42) MAPTSMN1; SMN2TP53TSHRHTT
SCHEMBL30689359 0.81 IP6K1 (0.39) MAPTSMN1; SMN2NPC1TP53RAB9A
SCHEMBL30689409 0.81 FFAR4 (0.41) TP53TSHRGSTP1FFAR1KMT2A
SCHEMBL31527877 0.77 GSTP1 (0.44) SMN1; SMN2NPC1TP53RAB9AS1PR1
SCHEMBL31528053 0.77 TSHR (0.44) MAPTSMN1; SMN2NPC1TSHRRAB9A
SCHEMBL30689305 0.77 IP6K1 (0.38) MAPTSMN1; SMN2NPC1HTTNPSR1

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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