SCHEMBL30875941

SCHEMBL30875941

CC(C)(C)OC(=O)NCCN1CCNC(=O)C1.NCCN1CCN(CC(=O)O)C(=O)C1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.39
CACNA1H O95180 1/20 0.38
SIGMAR1 Q99720 2/20 0.35
ALDH1A1 P00352 1/20 0.33
GFER P55789 1/20 0.33
ITGB3 P05106 1/20 0.33
ITGA2B P08514 1/20 0.33
SUCNR1 Q9BXA5 1/20 0.33
THRB P10828 1/20 0.32

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
SCHEMBL16096067 0.87 DRD2 (0.47) DRD2CACNA1HSIGMAR1ALDH1A1GFER
SCHEMBL13238482 0.84 DRD2 (0.47) DRD2CACNA1HSIGMAR1ALDH1A1GFER
SCHEMBL31496727 0.75 DRD2 (0.56) DRD2CACNA1HSIGMAR1ALDH1A1GFER
SCHEMBL30875935 0.74 ITGB3 (0.43) ITGB3ITGA2B
Hydrochloric Acid SCHEMBL25170707 0.73 DRD2 (0.55) DRD2CACNA1HSIGMAR1ALDH1A1GFER
SCHEMBL21389284 0.73 DRD2 (0.52) DRD2CACNA1HSIGMAR1ALDH1A1GFER
SCHEMBL30737230 0.71 CACNA1H (0.60) DRD2CACNA1HSIGMAR1SUCNR1
SCHEMBL31301221 0.71 DRD2 (0.55) DRD2CACNA1HSIGMAR1ALDH1A1GFER
SCHEMBL513795 0.70 MEN1 (0.55) DRD2CACNA1HSIGMAR1ALDH1A1GFER
SCHEMBL26452488 0.69 KMT2A (0.53) DRD2CACNA1HALDH1A1GFER

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
EP-4608454-A1 SELF-HYDROLYZING MALEIMIDES FOR BIOCONJUGATION Eli Lilly and Company (US) 2025-09-03 EP disclosed
WO-2024092219-A1 SELF-HYDROLYZING MALEIMIDES FOR BIOCONJUGATION ELI LILLY AND COMPANY (US) 2024-05-02 WO disclosed