SCHEMBL7974774

SCHEMBL7974774

CCN(CC)C(=O)Nc1ccc2c(c1)c1ccccc1n2CC.CCc1cccc(CC)c1NC(=O)Nc1ccc2c(c1)c1ccccc1n2CC.CCn1c2ccccc2c2cc(NC(=O)COc3ccc(C)cc3)ccc21.CCn1c2ccccc2c2cc(NC(C)=O)ccc21

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 14/20 0.59
TP53 P04637 5/20 0.59
KDM4E B2RXH2 7/20 0.58
HPGD P15428 2/20 0.58
SMN1; SMN2 Q16637 5/20 0.53
NPSR1 Q6W5P4 1/20 0.51
LMNA P02545 4/20 0.49
RXFP1 Q9HBX9 1/20 0.48
NPY5R Q15761 1/20 0.47
RORC P51449 1/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
ALDH1A1 P00352 1/20 0.44
HTT P42858 1/20 0.44

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
SCHEMBL7973755 0.82 MAPT (0.85) MAPTTP53KDM4EHPGDSMN1; SMN2
SCHEMBL4728756 0.75 MAPT (1.00) MAPTTP53KDM4EHPGDSMN1; SMN2
SCHEMBL7722815 0.71 NPSR1 (1.00) MAPTKDM4EHPGDSMN1; SMN2NPSR1
SCHEMBL7722764 0.67 NPSR1 (0.75) MAPTTP53KDM4EHPGDSMN1; SMN2
SCHEMBL1594500 0.67 NPY5R (1.00) MAPTKDM4EHPGDSMN1; SMN2NPSR1
SCHEMBL19189749 0.66 RORC (0.87) MAPTTP53KDM4EHPGDSMN1; SMN2
SCHEMBL7722834 0.66 MAPT (0.81) MAPTTP53KDM4EHPGDSMN1; SMN2
SCHEMBL1593423 0.66 MAPT (0.79) MAPTKDM4EHPGDSMN1; SMN2NPSR1
SCHEMBL14199692 0.66 MAPT (0.82) MAPTKDM4EHPGDSMN1; SMN2NPSR1
SCHEMBL7726215 0.66 NPSR1 (0.86) MAPTKDM4EHPGDSMN1; SMN2NPSR1

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-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO disclosed