SCHEMBL7320036

SCHEMBL7320036

CCN(C(=O)NN1CN(CC(=O)Nc2ccccc2N(C)C)Cc2c(OCCCC(=O)N(Cc3ccccc3)Cc3ccccc3)cccc21)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.35
TSHR P16473 2/20 0.35
MAPK1 P28482 2/20 0.35
NPC1 O15118 1/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
KMT2A Q03164 4/20 0.34
MEN1 O00255 3/20 0.34
CYP2D6 P10635 2/20 0.33
CYP2C19 P33261 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
ALDH1A1 P00352 2/20 0.32
POLB P06746 1/20 0.32
KCNQ2 O43526 1/20 0.31
MAPT P10636 2/20 0.31
TP53 P04637 1/20 0.31
S1PR5 Q9H228 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL7313145 0.73 PDE4A (0.43) LMNATSHRMAPK1NPC1ALOX15
SCHEMBL7318644 0.71 PDE3B (0.35) LMNATSHRMAPK1NPC1ALOX15
SCHEMBL7320125 0.70 PDE4A (0.43) LMNATSHRMAPK1NPC1ALOX15
SCHEMBL7316957 0.69 PDE3B (0.35) LMNATSHRMAPK1NPC1ALOX15
SCHEMBL7317853 0.69 KCNQ2 (0.39) LMNATSHRMAPK1NPC1ALOX15
SCHEMBL7308383 0.68 PDE3B (0.41) LMNATSHRMAPK1NPC1ALOX15
SCHEMBL7312619 0.68 PDE3B (0.33) LMNANPC1KMT2AMEN1ALDH1A1
SCHEMBL7316967 0.67 TSHR (0.37) LMNATSHRMAPK1NPC1ALOX15
SCHEMBL7319375 0.64 PDE3B (0.44)
SCHEMBL7318255 0.64 PDE4A (0.39) S1PR5

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
US-4739056-A ENZYME INHIBITORS SYNTEX (U.S.A.) INC. (US) 1988-04-19 US disclosed