SCHEMBL23316907

SCHEMBL23316907

CNC(=O)CN(CC(N)=O)CC(=O)NC

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.34
LMNA P02545 1/20 0.34
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30
CYP2C19 P33261 1/20 0.30
HIF1A Q16665 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL19841461 1.00 MCL1 (0.34) MCL1LMNAOPRM1OPRL1ALOX15
SCHEMBL23587946 0.92 CTSD (0.35) MCL1LMNA
SCHEMBL21846058 0.85 CA1 (0.32)
SCHEMBL16312954 0.84 TDP1 (0.32) LMNAALOX15TSHRCYP2C19TDP1
SCHEMBL13166148 0.84 TDP1 (0.52) LMNAALOX15TSHRCYP2C19TDP1
SCHEMBL23316914 0.83 HTR7 (0.31)
SCHEMBL19058025 0.82 TDP1 (0.31) LMNAALOX15TSHRCYP2C19TDP1
SCHEMBL19057947 0.82 TDP1 (0.31) LMNAALOX15TSHRCYP2C19TDP1
SCHEMBL23317022 0.82 KDM4E (0.40)
SCHEMBL19841396 0.81 CTSD (0.41) MCL1LMNAOPRM1OPRL1ALOX15

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-2023091441-A1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES COMPRISING A TETRA-VALENT SUGAR CLUSTER FOR TREATMENT OF DIABETES MERCK SHARP & DOHME LLC (US) 2023-05-25 WO disclosed
EP-3052134-B1 GLUCOSE-RESPONSIVE INSULIN CONJUGATES MERCK SHARP & DOHME (US) 2021-05-05 EP disclosed