SCHEMBL26689262

SCHEMBL26689262

CC(C)(C)OC(=O)NCCCCC(NC(=O)CCOCCOCCOCCC(=O)O)C(=O)NCCOCCOCCOCCC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GLP1R P43220 8/20 0.52
CA1 P00915 3/20 0.45
CA2 P00918 3/20 0.45
SIRT5 Q9NXA8 1/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
KMT2A Q03164 1/20 0.44
CTSS P25774 2/20 0.42
CTSK P43235 2/20 0.42
CAPN1 P07384 1/20 0.42
TDP1 Q9NUW8 2/20 0.40
ATM Q13315 1/20 0.39
FOLH1 Q04609 1/20 0.39

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
SCHEMBL26689259 1.00 GLP1R (0.52) GLP1RCA1CA2SIRT5MEN1
SCHEMBL26689380 1.00 GLP1R (0.52) GLP1RCA1CA2SIRT5MEN1
SCHEMBL26689385 1.00 GLP1R (0.52) GLP1RCA1CA2SIRT5MEN1
SCHEMBL24667758 0.98 GLP1R (0.55) GLP1RCA1CA2SIRT5MEN1
SCHEMBL26689250 0.95 GLP1R (0.49) GLP1RCA1CA2SIRT5MEN1
SCHEMBL26689252 0.95 GLP1R (0.49) GLP1RCA1CA2SIRT5MEN1
SCHEMBL26689108 0.95 GLP1R (0.49) GLP1RCA1CA2SIRT5MEN1
SCHEMBL26689110 0.95 GLP1R (0.49) GLP1RCA1CA2SIRT5MEN1
SCHEMBL23077723 0.94 CTSS (0.49) GLP1RCA1CA2SIRT5MEN1
SCHEMBL15919180 0.94 CTSS (0.49) GLP1RCA1CA2SIRT5MEN1

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
WO-2023225359-A1 ANTIBODY-DRUG CONJUGATES OF ANTINEOPLASTIC COMPOUNDS AND METHODS OF USE THEREOF NOVARTIS AG (CH) 2023-11-23 WO disclosed
WO-2023223097-A1 ANTIBODY DRUG CONJUGATES NOVARTIS AG (CH) 2023-11-23 WO disclosed