SCHEMBL7666407

SCHEMBL7666407

O=c1c(Cc2cccnc2)cn2c3cc(Br)ccc3/c(=N\O)c3cc(OCc4cccnc4)cc1c32

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.35
GABRA5 P31644 1/20 0.35
PKM P14618 2/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HIF1A Q16665 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PRKDC P78527 3/20 0.33
FPR1 P21462 1/20 0.33
FPR2 P25090 1/20 0.33
GRM2 Q14416 1/20 0.33
LRRK2 Q5S007 1/20 0.32
ACHE P22303 1/20 0.32
MAOB P27338 1/20 0.32
CYP19A1 P11511 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
F9 P00740 1/20 0.31
F10 P00742 1/20 0.31
MEN1 O00255 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
SCHEMBL7666416 1.00 GABRA1 (0.35) GABRA1GABRA5PKMALDH1A1MAPT
SCHEMBL7669409 0.93 GABRA1 (0.35) GABRA1GABRA5PKMALDH1A1MAPT
SCHEMBL7669413 0.93 GABRA1 (0.35) GABRA1GABRA5PKMALDH1A1MAPT
SCHEMBL7671373 0.91 GABRA1 (0.34) GABRA1GABRA5PKMFPR1FPR2
SCHEMBL7671370 0.91 GABRA1 (0.34) GABRA1GABRA5PKMFPR1FPR2
SCHEMBL7673131 0.91 GABRA1 (0.39) GABRA1GABRA5PKMALDH1A1MAPT
SCHEMBL6977199 0.91 GABRA1 (0.39) GABRA1GABRA5PKMALDH1A1MAPT
SCHEMBL7668943 0.88 GABRA1 (0.30) GABRA1GABRA5
SCHEMBL7672601 0.87 LTA4H (0.44) ALDH1A1MEN1KMT2A
SCHEMBL7672607 0.87 LTA4H (0.44) ALDH1A1MEN1KMT2A

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
US-6476021-B1 Compounds having cGMP-PDE inhibitory effect MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-11-05 US disclosed
EP-1048666-A1 NOVEL COMPOUNDS HAVING cGMP-PDE INHIBITORY EFFECT MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2000-11-02 EP disclosed