SCHEMBL5040662

SCHEMBL5040662

COc1cccc(C(=O)Cn2c(-c3nonc3N)nc3ccccc32)c1.O=CNO

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BCHE P06276 4/20 0.63
SMN1; SMN2 Q16637 2/20 0.61
TSHR P16473 2/20 0.61
MEN1 O00255 1/20 0.61
MAPT P10636 1/20 0.61
KMT2A Q03164 1/20 0.61
KDM4E B2RXH2 1/20 0.56
TP53 P04637 1/20 0.56
LMNA P02545 1/20 0.56
RPS6KB1 P23443 1/20 0.55

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
SCHEMBL1385703 0.94 TSHR (0.68) BCHESMN1; SMN2TSHRMEN1MAPT
SCHEMBL5037311 0.88 KDM4E (0.70) BCHETSHRMAPTKDM4ERPS6KB1
SCHEMBL1386316 0.84 BCHE (0.68) BCHESMN1; SMN2TSHRMEN1MAPT
SCHEMBL5037898 0.83 KDM4E (0.62) BCHESMN1; SMN2KDM4ETP53
SCHEMBL5041207 0.83 KDM4E (0.65) SMN1; SMN2TSHRMEN1MAPTKMT2A
SCHEMBL5037413 0.83 KDM4E (0.62) BCHESMN1; SMN2TSHRMEN1MAPT
SCHEMBL1386849 0.82 TSHR (0.66) BCHESMN1; SMN2TSHRMEN1MAPT
SCHEMBL28787639 0.81 BCHE (0.86) BCHESMN1; SMN2MAPTTP53
SCHEMBL29728205 0.81 BCHE (0.86) BCHESMN1; SMN2MAPTTP53
SCHEMBL1385815 0.81 TSHR (0.65) BCHESMN1; SMN2TSHRMEN1MAPT

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-1636215-B1 FURAZANOBENZIMIDAZOLES BASILEA PHARMACEUTICA AG (CH) 2008-01-23 EP claimed