SCHEMBL22054574

SCHEMBL22054574

CC(=O)C(CCCCN)NC1CCCC1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CPB2 Q96IY4 12/20 0.45
▸ ITGB3 P05106 3/20 0.41
▸ ITGA2B P08514 3/20 0.41
▸ SMN1; SMN2 Q16637 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
SCHEMBL22054642 0.98 CPB2 (0.47) CPB2ITGB3ITGA2BSMN1; SMN2
SCHEMBL17453157 0.98 CPB2 (0.47) CPB2ITGB3ITGA2BSMN1; SMN2
SCHEMBL9181564 0.85 CPB2 (0.55) CPB2
SCHEMBL9181567 0.85 CPB2 (0.55) CPB2
SCHEMBL5736086 0.84 CPB2 (0.57) CPB2SMN1; SMN2
SCHEMBL20792784 0.81 SMN1; SMN2 (0.45) SMN1; SMN2
SCHEMBL22054572 0.81 SMN1; SMN2 (0.45) SMN1; SMN2
SCHEMBL25573548 0.81 SMN1; SMN2 (0.45) SMN1; SMN2
SCHEMBL22054640 0.81 SMN1; SMN2 (0.45) SMN1; SMN2
SCHEMBL22053731 0.79 SMN1; SMN2 (0.43) SMN1; SMN2

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-2020107078-A1 DENDRIMER FOR THERAPY AND IMAGING STARPHARMA PTY LTD (AU) 2020-06-04 — — WO disclosed
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