SCHEMBL29935626

SCHEMBL29935626

C=C1NC(=O)OC12CCNCC2

nearest known ligand 0.43

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 2/20 0.37
DRD2 P14416 1/20 0.33
NEK2 P51955 1/20 0.31

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
SCHEMBL4461573 0.78 SIGMAR1 (0.39) SIGMAR1DRD2NEK2
SCHEMBL18353161 0.73 SIGMAR1 (0.31) SIGMAR1
SCHEMBL5389801 0.71 CRBN (0.37) SIGMAR1DRD2
SCHEMBL9373179 0.69 LMNA (0.34) SIGMAR1DRD2
SCHEMBL9373229 0.69 SIGMAR1 (0.36) SIGMAR1DRD2NEK2
SCHEMBL15088421 0.67 SIGMAR1 (0.35) SIGMAR1DRD2
SCHEMBL722997 0.67 BACE1 (0.47) SIGMAR1DRD2
SCHEMBL7294932 0.66 SIGMAR1 (0.31) SIGMAR1
SCHEMBL7290522 0.66 SIGMAR1 (0.31) SIGMAR1
Hydrochloric Acid SCHEMBL1285606 0.66 MAPK1 (0.49) SIGMAR1DRD2

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
US-20220290159-A1 miRNAS FOR REDUCING VENTRICLE ENLARGEMENT St. Jude Children's Research Hpspital, Inc. (US) 2022-09-15 US disclosed