SCHEMBL9215901

SCHEMBL9215901

CC(O)c1c(N(C)C)c2cccnc2n(-c2cccc(Cl)c2)c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
MEN1 O00255 1/20 0.44
HPGD P15428 1/20 0.44
KMT2A Q03164 1/20 0.44
PDE4B Q07343 6/20 0.42
PDE4D Q08499 6/20 0.42
PDE4A P27815 6/20 0.42
PDE4C Q08493 5/20 0.42
FEN1 P39748 1/20 0.38
KDM4E B2RXH2 2/20 0.37
POLB P06746 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
DRD1 P21728 1/20 0.37
DRD5 P21918 1/20 0.37
HTR2A P28223 1/20 0.36
HTR2C P28335 1/20 0.36
HTR7 P34969 1/20 0.36

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
SCHEMBL9799559 0.74 CYP1A2 (0.44) MAPTCYP1A2CYP2C19MEN1HPGD
SCHEMBL4344651 0.74 MAPT (0.50) MAPTCYP1A2CYP2C19MEN1HPGD
SCHEMBL5949580 0.71 CYP1A2 (0.47) MAPTCYP1A2CYP2C19MEN1HPGD
SCHEMBL10427752 0.71 KMT2A (0.50) MAPTCYP1A2CYP2C19MEN1HPGD
SCHEMBL9267553 0.71 MAPT (0.47) MAPTCYP1A2CYP2C19MEN1HPGD
SCHEMBL9535601 0.69 MAPT (0.50) MAPTCYP1A2CYP2C19MEN1HPGD
SCHEMBL7272901 0.68 PDE4A (0.48) MAPTCYP1A2CYP2C19MEN1HPGD
Water SCHEMBL10427748 0.68 MAPT (0.44) MAPTCYP1A2CYP2C19MEN1HPGD
SCHEMBL7273701 0.68 PDE4A (0.76) MAPTCYP1A2CYP2C19MEN1HPGD
SCHEMBL7281964 0.67 HPGD (0.53) MAPTCYP1A2CYP2C19MEN1HPGD

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
JP-7126268-A None JP disclosed
JP-H07126268-A 1,8-NAPHTHYRIDINE DERIVATIVE OTSUKA PHARMACEUT FACTORY INC 1995-05-16 JP disclosed