SCHEMBL7583319

SCHEMBL7583319

CCN(CC)C(O)Cc1cccc2cc(C)c(-c3ccccc3)nc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.43
PDE1A P54750 1/20 0.38
PDE1B Q01064 1/20 0.38
PDE1C Q14123 1/20 0.38
GAA P10253 1/20 0.34
ERBB2 P04626 1/20 0.33
PDK1 Q15118 4/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 1/20 0.33
ATM Q13315 1/20 0.33
TACR3 P29371 1/20 0.32
CYP2C9 P11712 1/20 0.32
KDM4E B2RXH2 2/20 0.32
NR4A2 P43354 1/20 0.32
PIK3CD O00329 1/20 0.32
MEN1 O00255 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 1/20 0.31
PKM P14618 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL7588247 0.84 MBNL1 (0.47) GAAALDH1A1ATMKDM4EPIK3CD
SCHEMBL7774860 0.84 KMT2A (0.38) KDM4EMEN1KMT2A
SCHEMBL7583585 0.79 PARP1 (0.43) ALDH1A1KDM4EMEN1RAB9AKMT2A
SCHEMBL7210617 0.76 PDE10A (0.43) PDE10APDE1APDE1BPDE1CGAA
SCHEMBL7115774 0.76 PDE10A (0.40) PDE10APDE1APDE1BPDE1CGAA
SCHEMBL8003719 0.76 METAP2 (0.45) ALDH1A1CYP2C9MEN1POLBRAB9A
SCHEMBL7121500 0.74 PDE10A (0.43) PDE10APDE1APDE1BPDE1CGAA
Hydrochloric Acid SCHEMBL7118613 0.73 PDE10A (0.42) PDE10APDE1APDE1BPDE1CGAA
SCHEMBL8007841 0.72 PARP1 (0.46) PDE10A
SCHEMBL28539195 0.71 PDE10A (0.62) PDE10APDE1APDE1BPDE1CGAA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1240146-A1 2-ARYLQUINOLINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-SYNTHELABO (FR) 2002-09-18 EP claimed
WO-2001038310-A1 2-ARYLQUINOLINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-SYNTHELABO (FR) 2001-05-31 WO claimed
EP-1240146-A1 2-ARYLQUINOLINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-SYNTHELABO (FR) 2002-09-18 EP disclosed
WO-2001038310-A1 2-ARYLQUINOLINE DERIVATIVES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI-SYNTHELABO (FR) 2001-05-31 WO disclosed