SCHEMBL7487232

SCHEMBL7487232

Nc1nc(Cc2cccc(C(=O)c3ccccc3)c2)n[nH]1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MPO P05164 4/20 0.55
PBRM1 Q86U86 1/20 0.45
ABL1 P00519 1/20 0.45
FABP6 P51161 1/20 0.45
ATM Q13315 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
LMNA P02545 1/20 0.43
GLA P06280 1/20 0.43
CYP19A1 P11511 2/20 0.42
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39
VNN1 O95497 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39

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
SCHEMBL960185 0.80 LTB4R (0.49) MPOLMNAGLAALDH1A1MAPT
SCHEMBL28355292 0.73 ALDH1A1 (0.50) TDP1L3MBTL1LMNAGLAALDH1A1
SCHEMBL21974599 0.72 L3MBTL1 (0.67) MPOPBRM1ATMTDP1L3MBTL1
SCHEMBL2578134 0.72 ALDH1A1 (0.46) PBRM1ABL1FABP6ATMTDP1
SCHEMBL23098254 0.72 ATM (0.61) MPOPBRM1ATMTDP1L3MBTL1
SCHEMBL7484753 0.71 MPO (0.46) MPOLMNAALDH1A1MEN1KMT2A
SCHEMBL15544824 0.71 GAA (0.64) MAPTMEN1KMT2A
SCHEMBL2900640 0.70 ATM (0.63) PBRM1ATMTDP1L3MBTL1CYP19A1
SCHEMBL7491732 0.69 MAPT (0.51) PBRM1ABL1FABP6ATMTDP1
SCHEMBL7487352 0.69 PBRM1 (0.43) MPOPBRM1ABL1FABP6ATM

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
EP-1201661-A1 HETEROAROMATIC RING COMPOUNDS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2002-05-02 EP disclosed