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SCHEMBL27384602

SCHEMBL27384602

CCC(C)(C)COCC(C)(C)CNC(=O)CCOCCOCCOCCOCCN(CCOCCOCCOCCOCCC(=O)NCC(C)(C)COC(C)(C)CC(N)=O)C(=O)c1ccc(-c2nnc(SC)o2)cc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ POLB P06746 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ GAA P10253 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CXCR4 P61073 1/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL26033158 0.78 POLB (0.40) POLBALDH1A1GAALMNATP53
SCHEMBL25835917 0.77 POLB (0.41) POLBALDH1A1GAALMNATP53
SCHEMBL26036326 0.75 CXCR4 (0.34) POLBALDH1A1GAALMNATP53
SCHEMBL26048769 0.74 L3MBTL1 (0.30) L3MBTL1
SCHEMBL26037656 0.70 L3MBTL1 (0.32) L3MBTL1
SCHEMBL25836299 0.69 DRD2 (0.38) POLBCXCR4
SCHEMBL26032119 0.69 POLB (0.36) POLBALDH1A1LMNATP53MAPT
SCHEMBL26032132 0.69 POLB (0.36) POLBALDH1A1LMNATP53MAPT
SCHEMBL25850274 0.64 CNR1 (0.32) ALDH1A1MAPTSMN1; SMN2
SCHEMBL25835923 0.64 POLB (0.33) L3MBTL1POLBALDH1A1GAALMNA

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-2024086633-A1 RNAI AGENTS FOR INHIBITING EXPRESSION OF DM1 PROTEIN KINASE (DMPK) COMPOSITIONS THEREOF, AND METHODS OF USE Arrowhead Pharmaceuticals, Inc. (US) 2024-04-25 — — WO disclosed