SCHEMBL14217482

SCHEMBL14217482

N=Cc1c(Oc2ccc(N)cc2)ccnc1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
APAF1 O14727 1/20 0.44
ALDH1A1 P00352 5/20 0.42
TDP1 Q9NUW8 2/20 0.42
CYP3A4 P08684 1/20 0.42
TSHR P16473 1/20 0.42
AURKA O14965 1/20 0.39
MAOA P21397 2/20 0.37
NCOA1 Q15788 1/20 0.37
NCOA3 Q9Y6Q9 1/20 0.37
MAPT P10636 5/20 0.36
TEAD4 Q15561 1/20 0.36
MAOB P27338 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
POLB P06746 1/20 0.35
MITF O75030 1/20 0.35
GAA P10253 1/20 0.35
GFER P55789 1/20 0.35
NLRP1 Q9C000 1/20 0.35

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
SCHEMBL12500837 0.83 MEN1 (0.41) MEN1KMT2AAPAF1ALDH1A1TDP1
SCHEMBL12663413 0.79 MEN1 (0.38) MEN1KMT2AAPAF1ALDH1A1TDP1
SCHEMBL3503209 0.78 HTT (0.41) MEN1KMT2AAPAF1ALDH1A1TDP1
SCHEMBL3503205 0.78 HTT (0.41) MEN1KMT2AAPAF1ALDH1A1TDP1
SCHEMBL14705754 0.76 MEN1 (0.47) MEN1KMT2AAPAF1ALDH1A1TDP1
SCHEMBL12673483 0.74 TSHR (0.36) MEN1KMT2AAPAF1ALDH1A1TDP1
SCHEMBL1893903 0.73 BTK (0.35) MEN1KMT2AAPAF1TDP1TSHR
SCHEMBL14217483 0.73 TYRO3 (0.31)
SCHEMBL25873402 0.72 MEN1 (0.47) MEN1KMT2AAPAF1ALDH1A1TDP1
SCHEMBL1893902 0.72 MAOB (0.39) ALDH1A1TDP1CYP3A4TSHRMAOA

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-1921078-A1 MULTIKINASE INHIBITOR CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2008-05-14 EP disclosed