SCHEMBL6979540

SCHEMBL6979540

COc1cccc2c1c1cccc3c(=O)c(Cc4cccnc4)cn2c31

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
IDO1 P14902 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRA5 P31644 1/20 0.37
ALDH1A1 P00352 5/20 0.37
KDM4E B2RXH2 4/20 0.37
GAA P10253 2/20 0.37
HTT P42858 2/20 0.37
GLA P06280 1/20 0.37
HPGD P15428 1/20 0.37
CASP1 P29466 1/20 0.37
CASP7 P55210 1/20 0.37
ATM Q13315 1/20 0.37
HSD17B10 Q99714 1/20 0.37
PDE10A Q9Y233 2/20 0.37
MAPK1 P28482 1/20 0.37
ADORA2A P29274 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 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
SCHEMBL6977266 0.87 CNR1 (0.42) CNR1CNR2IDO1ALDH1A1KDM4E
SCHEMBL6982514 0.87 CNR1 (0.39) CNR1CNR2IDO1GABRA1GABRA5
SCHEMBL6973978 0.83 CNR1 (0.39) CNR1CNR2IDO1GABRA1GABRA5
SCHEMBL7666493 0.82 GABRA1 (0.40) CNR1CNR2GABRA1GABRA5KDM4E
SCHEMBL6981815 0.81 GABRA1 (0.46) GABRA1GABRA5ALDH1A1KDM4EGAA
SCHEMBL6979014 0.80 GABRA1 (0.41) CNR1CNR2GABRA1GABRA5ALDH1A1
SCHEMBL6968571 0.77 GABRA1 (0.43) GABRA1GABRA5ALDH1A1HTTMAPK1
SCHEMBL6976958 0.76 GUSB (0.37) IDO1GABRA1GABRA5KDM4EHTT
SCHEMBL6981678 0.76 GABRA1 (0.46) CNR1CNR2GABRA1GABRA5ALDH1A1
SCHEMBL8144941 0.75 CYP19A1 (0.38) IDO1GABRA1GABRA5ALDH1A1KDM4E

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-0985671-B1 PYRIDOCARBAZOLE DERIVATIVES HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARM CO LTD (JP) 2003-04-02 EP disclosed
US-6197768-B1 THERAPY, PREVENTION ISCHEMIC HEART DISEASE MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2001-03-06 US disclosed
EP-0985671-A1 PYRIDOCARBAZOLE DERIVATIVES HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-03-15 EP disclosed
US-6018046-A SELECTIVE ACTION IN INHIBITING CYCLIC GMP-PHOSPHODIESTERASE (CGMP-PDE); PHARMACEUTICALS FOR TREATING DISEASES AGAINST WHICH THE INHIBITORY ACTION IS EFFECTIVE, SUCH AS PULMONARY HYPERTENSION MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-01-25 US disclosed