SCHEMBL23635323

SCHEMBL23635323

CS/C(=C(/N)C#N)N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CTSK P43235 1/20 0.39
GPR119 Q8TDV5 4/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
HPGD P15428 1/20 0.38
EPHX2 P34913 1/20 0.37
DPP4 P27487 1/20 0.37
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36

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
SCHEMBL6189015 0.87 USP2 (0.46) USP2SMN1; SMN2CTSKGPR119MEN1
SCHEMBL698803 0.74 USP2 (0.69) USP2SMN1; SMN2GPR119MEN1KMT2A
SCHEMBL18294 0.74 USP2 (0.69) USP2SMN1; SMN2GPR119MEN1KMT2A
SCHEMBL12615141 0.73 USP2 (0.42) USP2SMN1; SMN2CTSKGPR119MEN1
SCHEMBL23635372 0.73 HPGD (0.52) GPR119MEN1KMT2AALDH1A1MAPT
SCHEMBL16370880 0.72 USP2 (0.44) USP2SMN1; SMN2CTSKGPR119MEN1
SCHEMBL16825742 0.72 ALDH1A1 (0.65) USP2SMN1; SMN2CTSKMEN1KMT2A
SCHEMBL15863855 0.72 USP2 (0.44) USP2SMN1; SMN2CTSKGPR119MEN1
SCHEMBL12697881 0.72 USP2 (0.44) USP2SMN1; SMN2CTSKGPR119MEN1
SCHEMBL16846230 0.72 ALDH1A1 (0.65) USP2SMN1; SMN2CTSKMEN1KMT2A

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-2021142420-A1 PYRAZOLO[1,5-a]PYRIMIDIN-7(4H)-ONE INHIBITORS OF DYNEIN KAPOOR TARUN M (US) 2021-07-15 WO disclosed