SCHEMBL1736992

SCHEMBL1736992

Cc1ccc(C)c(N2CCN(C(=O)C3CN(S(=O)(=O)c4ccc(C)c(O)c4)C(=O)N3c3ccccc3)CC2)c1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.49
MAPT P10636 6/20 0.49
TP53 P04637 3/20 0.46
SMN1; SMN2 Q16637 4/20 0.45
HTT P42858 2/20 0.42
TSHR P16473 2/20 0.42
USP2 O75604 5/20 0.42
NPSR1 Q6W5P4 1/20 0.41
CYP2C9 P11712 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40

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
SCHEMBL1736733 0.93 LMNA (0.54) LMNAMAPTTP53SMN1; SMN2HTT
SCHEMBL1736731 0.93 LMNA (0.54) LMNAMAPTTP53SMN1; SMN2HTT
SCHEMBL1734775 0.92 MAPT (0.52) LMNAMAPTTP53SMN1; SMN2HTT
SCHEMBL1735837 0.92 MAPT (0.52) LMNAMAPTTP53SMN1; SMN2HTT
SCHEMBL1734779 0.92 MAPT (0.52) LMNAMAPTTP53SMN1; SMN2HTT
SCHEMBL1735711 0.88 LMNA (0.51) LMNAMAPTTP53SMN1; SMN2HTT
SCHEMBL1734790 0.88 LMNA (0.46) LMNAMAPTTP53SMN1; SMN2HTT
SCHEMBL1734791 0.88 LMNA (0.46) LMNAMAPTTP53SMN1; SMN2HTT
SCHEMBL1735709 0.88 LMNA (0.51) LMNAMAPTTP53SMN1; SMN2HTT
SCHEMBL1734767 0.87 MAPT (0.44) LMNAMAPTTP53SMN1; SMN2TSHR

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
EP-2142533-B1 IMIDAZOLIDINONE DERIVATIVES HOFFMANN LA ROCHE (CH) 2011-11-16 EP claimed
WO-2011069003-A3 METHODS AND SYSTEMS FOR THE TREATMENT OF ANXIETY DISORDERS AND DISORDERS WITH PSYCHOTIC FEATURES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-10-27 WO claimed