SCHEMBL31527959

SCHEMBL31527959

C=C(Cc1nc(-c2ccc(Oc3cccnn3)cc2)no1)C(=O)O

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.42
▸ ATM Q13315 1/20 0.42
▸ TP53 P04637 3/20 0.40
▸ MITF O75030 1/20 0.40
▸ NCOA3 Q9Y6Q9 1/20 0.40
▸ ACACB O00763 6/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GSTP1 P09211 2/20 0.39
▸ PPARD Q03181 2/20 0.39
▸ PPARA Q07869 2/20 0.39
▸ FFAR1 O14842 1/20 0.39
▸ TSHR P16473 1/20 0.38
▸ NFKB1 P19838 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ NFKB2 Q00653 1/20 0.38
▸ RELA Q04206 1/20 0.38
▸ MAPT P10636 1/20 0.38

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
SCHEMBL30689347 0.86 IP6K1 (0.48) LMNAATMTP53MITFNCOA3
SCHEMBL30689392 0.83 LMNA (0.44) LMNAATMTP53MITFNCOA3
SCHEMBL31527827 0.83 TP53 (0.46) LMNAATMTP53MITFNCOA3
SCHEMBL31527955 0.82 LMNA (0.46) LMNAATMTP53MITFNCOA3
SCHEMBL31527948 0.82 PSMB5 (0.49) LMNAATMTP53ACACBALDH1A1
SCHEMBL31528007 0.81 MITF (0.43) LMNAATMTP53MITFNCOA3
SCHEMBL30689323 0.81 TP53 (0.42) LMNAATMTP53MITFNCOA3
SCHEMBL30689351 0.81 FFAR1 (0.41) LMNAATMTP53MITFNCOA3
SCHEMBL30689449 0.81 LMNA (0.44) LMNAATMTP53MITFNCOA3
SCHEMBL30689419 0.80 FFAR1 (0.53) LMNAATMTP53MITFNCOA3

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
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
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