SCHEMBL25708285

SCHEMBL25708285

COCCOCCOCCOCCNC(=O)CC[C@H](N)C(=O)NCCOCCOCCOCCOC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ TSHR P16473 1/20 0.42
▸ CA2 P00918 2/20 0.40
▸ DPP7 Q9UHL4 2/20 0.40
▸ GLP1R P43220 8/20 0.39
▸ NOD1 Q9Y239 1/20 0.38
▸ LTA4H P09960 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ HPGD P15428 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ GPBAR1 Q8TDU6 1/20 0.37
▸ TLR2 O60603 1/20 0.37

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
SCHEMBL15507860 0.95 MEN1 (0.42) MEN1KMT2ATSHRCA2DPP7
SCHEMBL15503622 0.89 MEN1 (0.40) MEN1KMT2ATSHRCA2DPP7
SCHEMBL15503547 0.89 MEN1 (0.40) MEN1KMT2ATSHRCA2DPP7
SCHEMBL12266591 0.88 CA2 (0.50) MEN1KMT2ACA2DPP7LTA4H
SCHEMBL13566444 0.88 CA2 (0.50) MEN1KMT2ACA2DPP7LTA4H
SCHEMBL31370639 0.88 DDAH1 (0.43) MEN1KMT2ATSHRGLP1RNOD1
SCHEMBL30202320 0.88 DDAH1 (0.43) MEN1KMT2ATSHRGLP1RNOD1
SCHEMBL29336452 0.88 DDAH1 (0.43) MEN1KMT2ATSHRGLP1RNOD1
SCHEMBL25835481 0.87 DPP7 (0.47) MEN1KMT2ADPP7GLP1RNOD1
SCHEMBL29467645 0.86 PLK1 (0.45) TSHRDPP7GLP1RLTA4HTLR2

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-2023109942-A1 COMPOUND-LINKER CONSTRUCTS COMPRISING NOVEL COMPOUNDS USEFUL AS STING AGONISTS AND USES THEREOF JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2023-06-22 — — WO disclosed
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