SCHEMBL6983094

SCHEMBL6983094

Cc1cncc(COc2cc3c(=O)ccn4c5ccc(Br)cc5c(c2)c34)c1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 9/20 0.33
MAOA P21397 6/20 0.33
PIK3R1 P27986 2/20 0.33
PIK3CA P42336 2/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
MMP12 P39900 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRA5 P31644 1/20 0.32
GRM2 Q14416 1/20 0.32
MEN1 O00255 1/20 0.31
SLC26A4 O43511 1/20 0.31
BLM P54132 1/20 0.31
KMT2A Q03164 1/20 0.31
ATM Q13315 1/20 0.31
AR P10275 1/20 0.30
CYP19A1 P11511 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
SCHEMBL7087746 0.88 MAOA (0.33) MAOBMAOACYP11B1CYP11B2
SCHEMBL6978806 0.85 GRM2 (0.41) MAOBMAOACYP11B1CYP11B2GABRA1
SCHEMBL8157787 0.82 MAOB (0.44) MAOBMAOAMEN1KMT2A
SCHEMBL8152607 0.77 LMNA (0.36) PIK3R1PIK3CAMEN1KMT2A
SCHEMBL8157652 0.76 MAOA (0.34) MAOBMAOAPIK3R1PIK3CA
SCHEMBL6982438 0.76 PIK3R1 (0.39) PIK3R1PIK3CAGABRA1GABRA5MEN1
SCHEMBL6983135 0.76 PTGDR2 (0.39) MEN1KMT2A
SCHEMBL6976234 0.75 NPC1 (0.38)
SCHEMBL6971985 0.75 SMN1; SMN2 (0.43) MEN1KMT2A
SCHEMBL7083107 0.74 IDO1 (0.33) MAOBMAOA

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