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SCHEMBL25830922

SCHEMBL25830922

CC1(C)CN(Cc2c(F)cccc2Cl)c2cc(C(=O)NCc3c(F)cc(C#CC(=O)NCCOCCNC(=O)Cn4ccc5cc(C(=O)NCCc6ccc(N)cc6)cnc54)cc3F)ccc21

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 2/20 0.37
▸ TP53 P04637 2/20 0.34
▸ MAPT P10636 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PDE4B Q07343 1/20 0.31
▸ LMNA P02545 1/20 0.30
▸ KLKB1 P03952 1/20 0.30
▸ PPARG P37231 1/20 0.30

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
SCHEMBL25830944 0.92 STING1 (0.35) STING1TP53MAPT
SCHEMBL25830940 0.81 STING1 (0.49) STING1TP53MAPTSMN1; SMN2LMNA
SCHEMBL25807890 0.75 STING1 (0.48) STING1TP53MAPTSMN1; SMN2LMNA
SCHEMBL30563377 0.74 STING1 (0.47) STING1TP53MAPTSMN1; SMN2LMNA
SCHEMBL25830558 0.71 STING1 (0.68) STING1TP53MAPTSMN1; SMN2LMNA
SCHEMBL25831153 0.70 STING1 (0.52) STING1TP53MAPTSMN1; SMN2LMNA
SCHEMBL25830557 0.67 STING1 (0.63) STING1TP53MAPTSMN1; SMN2LMNA
SCHEMBL25831175 0.64 STING1 (0.65) STING1TP53MAPTSMN1; SMN2LMNA
SCHEMBL25831112 0.64 STING1 (0.63) STING1TP53MAPTSMN1; SMN2LMNA
SCHEMBL25831445 0.64 STING1 (0.69) STING1TP53MAPTSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023122298-A1 PROTEIN STABILIZING COMPOUNDS CONTAINING USP28 AND/OR USP25 TARGETING LIGANDS Stablix, Inc. (US) 2023-06-29 — — WO disclosed