SCHEMBL18239095

SCHEMBL18239095

CC(C)c1nc2c([nH]1)CCC(=O)N2

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.34
GSK3B P49841 1/20 0.31
PDE3B Q13370 1/20 0.31
PDE3A Q14432 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
SCHEMBL19152670 0.76 CRBN (0.39) CRBNPDE3BPDE3A
SCHEMBL18238541 0.71 CRBN (0.34) CRBNGSK3B
SCHEMBL18238976 0.69 KDM5B (0.31)
SCHEMBL2510671 0.64 KMT2A (0.44) GSK3B
SCHEMBL2502652 0.64 L3MBTL1 (0.47) GSK3B
SCHEMBL18238526 0.63 CRBN (0.33) CRBNPDE3BPDE3A
SCHEMBL18238957 0.63 GSK3B (0.33) GSK3B
SCHEMBL18237570 0.63 CRBN (0.33) CRBNPDE3BPDE3A
SCHEMBL18238972 0.63 GSK3B (0.33) GSK3B
SCHEMBL13111251 0.62 PDE3B (0.43) CRBNPDE3BPDE3A

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-2016183359-A1 SILICON BASED DRUG CONJUGATES AND METHODS OF USING SAME BLINKBIO, INC. (US) 2016-11-17 WO disclosed