SCHEMBL7948833

SCHEMBL7948833

Cc1cn2c(-c3ccc4c(=O)[nH]cc(Cl)c4c3)ccc(N)c2n1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 11/20 0.36
WDR77 Q9BQA1 11/20 0.36
TGFBR1 P36897 1/20 0.32
HTR3A P46098 1/20 0.31
HTR4 Q13639 1/20 0.31
PTK6 Q13882 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
NFKB1 P19838 1/20 0.30
RAB9A P51151 1/20 0.30
NFKB2 Q00653 1/20 0.30
KMT2A Q03164 1/20 0.30
RELA Q04206 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL2171011 0.85 PRMT5 (0.35) PRMT5WDR77
SCHEMBL2216150 0.72 MAT2A (0.40) PRMT5WDR77
SCHEMBL7945841 0.66 MAT2A (0.34) PRMT5WDR77
SCHEMBL31426340 0.65 PARP1 (0.46) PRMT5WDR77KDM4ENPC1ALDH1A1
SCHEMBL2215183 0.64 MAT2A (0.34) PRMT5WDR77
SCHEMBL2217605 0.64 LRRK2 (0.34) KDM4EMAPT
SCHEMBL27159684 0.62 PRMT5 (0.35) PRMT5WDR77
SCHEMBL24172897 0.60 MCL1 (0.41) KDM4E
SCHEMBL2170877 0.59 CHEK1 (0.46) ALDH1A1
SCHEMBL3305650 0.59 PARP1 (0.49) NPC1ALDH1A1MAPTRAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010035745-A1 HETEROCYCLIC BIARYL DERIVATIVE, AND PDE INHIBITOR COMPRISING SAME AS ACTIVE INGREDIENT 杏林製薬株式会社 (JP) 2010-04-01 WO disclosed