SCHEMBL23630299

SCHEMBL23630299

N#CC(C#N)C(=O)C1(c2ccc(Cl)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 13/20 0.47
HDAC4 P56524 1/20 0.45
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TET3 O43151 1/20 0.38
KMT2A Q03164 1/20 0.38
FBXL19 Q6PCT2 1/20 0.38
CXXC5 Q7LFL8 1/20 0.38
KDM2B Q8NHM5 1/20 0.38
CXXC4 Q9H2H0 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38
KDM4E B2RXH2 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL12158567 0.77 HSD11B1 (0.51) HSD11B1HDAC4LMNAL3MBTL1ALDH1A1
SCHEMBL1975025 0.74 HSD11B1 (0.56) HSD11B1HDAC4LMNAL3MBTL1ALDH1A1
SCHEMBL2321735 0.74 HSD11B1 (0.59) HSD11B1HDAC4LMNAL3MBTL1ALDH1A1
SCHEMBL23630293 0.73 SSTR1 (0.40) LMNAL3MBTL1ALDH1A1KMT2AHTT
SCHEMBL75310 0.72 TET3 (0.61) HSD11B1HDAC4TET3KMT2AFBXL19
SCHEMBL2097060 0.72 HSD11B1 (0.58) HSD11B1HDAC4LMNAL3MBTL1ALDH1A1
SCHEMBL3554737 0.72 HSD11B1 (0.58) HSD11B1HDAC4LMNAL3MBTL1ALDH1A1
SCHEMBL20564856 0.72 HDAC4 (0.47) HSD11B1HDAC4LMNAL3MBTL1ALDH1A1
SCHEMBL15113219 0.71 HDAC4 (0.54) HSD11B1HDAC4LMNAALDH1A1
SCHEMBL12020371 0.71 HSD11B1 (0.56) HSD11B1HDAC4LMNAL3MBTL1ALDH1A1

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