SCHEMBL18911532

SCHEMBL18911532

CC(C)(C)OC(=O)NOCCOCCOCCNC(=O)C(CCCCNC(=O)COC(C)(C)CCOC(C)(C)CCN=[N+]=[N-])NC(=O)COCCOCCN=[N+]=[N-]

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.39
▸ CA1 P00915 5/20 0.34
▸ CA2 P00918 5/20 0.34
▸ KDM4E B2RXH2 1/20 0.30
▸ EGLN1 Q9GZT9 1/20 0.30
▸ KDM2A Q9Y2K7 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
SCHEMBL18911933 0.92 GLP1R (0.45) GLP1RCA1CA2
SCHEMBL24618744 0.90 CA2 (0.34) GLP1RCA1CA2
SCHEMBL22454909 0.88 CTSS (0.34) GLP1RCA1CA2
SCHEMBL18912601 0.87 GLP1R (0.41) GLP1RCA1CA2
SCHEMBL18911535 0.84 GLP1R (0.42) GLP1RCA1CA2
SCHEMBL18906902 0.80 GLP1R (0.49) GLP1RCA1CA2
SCHEMBL18906906 0.80 GLP1R (0.49) GLP1RCA1CA2
SCHEMBL23995632 0.80 GLP1R (0.50) GLP1RCA1CA2
SCHEMBL21018605 0.78 GLP1R (0.44) GLP1RCA1CA2KDM4EEGLN1
SCHEMBL3485150 0.77 GLP1R (0.50) GLP1RKDM4EEGLN1KDM2A

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-2017089895-A1 ANTIBODY-DRUG CONJUGATES COMPRISING BRANCHED LINKERS AND METHODS RELATED THERETO LEGOCHEM BIOSCIENCES, INC. (KR) 2017-06-01 — — WO disclosed
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