SCHEMBL8210218

SCHEMBL8210218

CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)N(c1ccc(N=O)cc1)C2c1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CACNA1H O95180 13/20 0.46
TRPV1 Q8NER1 5/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL8205482 0.88 CACNA1H (0.55) CACNA1HTRPV1SMN1; SMN2
SCHEMBL14263432 0.88 CACNA1H (0.54) CACNA1HTRPV1MEN1KMT2A
SCHEMBL8217839 0.86 CACNA1H (0.49) CACNA1HTRPV1MEN1KMT2A
SCHEMBL8209853 0.86 TRPV1 (0.55) CACNA1HTRPV1HTTSMN1; SMN2NPSR1
SCHEMBL8210646 0.86 GPR119 (0.52) CACNA1H
SCHEMBL8202849 0.86 CACNA1H (0.49) CACNA1HTRPV1MEN1KMT2AHTT
SCHEMBL12876068 0.85 ALDH1A1 (0.54) CACNA1HTRPV1MEN1KMT2A
SCHEMBL8218916 0.84 CACNA1H (0.57) CACNA1HTRPV1
SCHEMBL8212128 0.84 STS (0.46) CACNA1HTRPV1
SCHEMBL8224619 0.83 CACNA1H (0.46) CACNA1HMEN1KMT2ANPSR1

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-2008033464-A2 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF DISORDERS OF THE LIPID METABOLISM SCHERING CORPORATION (US) 2008-03-20 WO disclosed