SCHEMBL302944

SCHEMBL302944

Cc1cc(NC(=O)NCCN2CCC(N(C)C(=O)C3(c4ccc(Cl)cc4)CC3)CC2)cc(C)n1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.46
MAPT P10636 7/20 0.44
TP53 P04637 5/20 0.44
SMN1; SMN2 Q16637 3/20 0.43
LMNA P02545 2/20 0.41
ALOX15 P16050 1/20 0.41
MAPK1 P28482 1/20 0.41
DRD2 P14416 2/20 0.40
MCHR1 Q99705 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL3559074 0.92 CNR1 (0.46) CNR1MAPTTP53SMN1; SMN2LMNA
SCHEMBL301630 0.90 MEN1 (0.44) TP53SMN1; SMN2LMNAMAPK1MCHR1
SCHEMBL3557526 0.85 CNR1 (0.42) CNR1MAPTTP53SMN1; SMN2LMNA
SCHEMBL3563077 0.83 CCR5 (0.54) CNR1MAPTTP53SMN1; SMN2
SCHEMBL3560776 0.83 UTS2R (0.46) MAPTTP53DRD2POLB
SCHEMBL3562203 0.82 MEN1 (0.44) TP53SMN1; SMN2LMNAMAPK1DRD2
SCHEMBL301764 0.80 MEN1 (0.45) MAPTTP53SMN1; SMN2LMNAMAPK1
SCHEMBL3554924 0.80 L3MBTL1 (0.51) CNR1MAPTTP53SMN1; SMN2LMNA
SCHEMBL3566766 0.78 CNR1 (0.48) CNR1MAPTTP53SMN1; SMN2LMNA
SCHEMBL3564369 0.78 CNR1 (0.48) CNR1MAPTTP53SMN1; SMN2LMNA

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
JP-4851328-B2 2012-01-11 JP claimed