SCHEMBL30689341

SCHEMBL30689341

CCOP(=O)(OCC)C(Cc1nc(-c2ccc(Oc3ccnc(C(F)(F)F)c3)cc2)no1)C(=O)OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 3/20 0.38
▸ HDAC4 P56524 3/20 0.38
▸ HDAC6 Q9UBN7 3/20 0.38
▸ PPARD Q03181 2/20 0.38
▸ PPARA Q07869 2/20 0.38
▸ TP53 P04637 2/20 0.37
▸ MITF O75030 1/20 0.37
▸ NCOA3 Q9Y6Q9 1/20 0.37
▸ KCNT1 Q5JUK3 2/20 0.36
▸ KCNH2 Q12809 2/20 0.36
▸ KCNQ1 P51787 1/20 0.36
▸ CACNA1C Q13936 1/20 0.36
▸ SCN5A Q14524 1/20 0.36
▸ KCNMB1 Q16558 1/20 0.36
▸ KCNT2 Q6UVM3 1/20 0.36
▸ GSTP1 P09211 3/20 0.35
▸ FFAR1 O14842 1/20 0.34
▸ LTA4H P09960 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34

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
SCHEMBL30689362 0.83 MITF (0.39) ACACBPPARDPPARATP53MITF
SCHEMBL23588079 0.82 ACACB (0.46) ACACBTP53MITFNCOA3FFAR1
SCHEMBL23578576 0.80 RAB9A (0.40) HDAC4HDAC6PPARATP53MITF
SCHEMBL25804401 0.80 TSHR (0.47) TP53SCN5ATSHRMAPTSMN1; SMN2
SCHEMBL23588293 0.80 HTT (0.40) TP53MITFNCOA3TSHRMAPT
SCHEMBL25807564 0.80 TP53 (0.39) TP53MITFNCOA3TSHRMAPT
SCHEMBL23588294 0.80 TP53 (0.39) TP53MITFNCOA3TSHRMAPT
SCHEMBL30689418 0.80 LTA4H (0.41) TP53MITFNCOA3KCNH2FFAR1
SCHEMBL23588138 0.79 TP53 (0.37) TP53MITFNCOA3TSHRMAPT
SCHEMBL23588289 0.79 PPARD (0.46) PPARDPPARATP53MITFNCOA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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