SCHEMBL14989064

SCHEMBL14989064

Cc1ccsc1OC(=O)Nc1cc(CN2CCC(N(C)C)C2)ccc1/C=C/c1n[nH]c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 5/20 0.54
▸ AURKB Q96GD4 5/20 0.54
▸ HDAC1 Q13547 2/20 0.37
▸ CSK P41240 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ GRM2 Q14416 1/20 0.34
▸ TNIK Q9UKE5 1/20 0.34
▸ PDGFRB P09619 2/20 0.34
▸ KDR P35968 2/20 0.34
▸ PIK3CD O00329 1/20 0.34
▸ NSD2 O96028 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ MITF O75030 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ JAK2 O60674 1/20 0.33
▸ SCN1A P35498 2/20 0.33
▸ SCN8A Q9UQD0 2/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ AXL P30530 1/20 0.33
▸ MERTK Q12866 1/20 0.33

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
SCHEMBL14988993 0.91 AURKA (0.54) AURKAAURKBHDAC1KDM4EKCNH2
SCHEMBL14989335 0.91 AURKA (0.54) AURKAAURKBHDAC1KCNH2
SCHEMBL14989359 0.91 AURKA (0.53) AURKAAURKBHDAC1TNIKPDGFRB
SCHEMBL4307930 0.89 AURKA (0.66) AURKAAURKBHDAC1CSKMAPK14
SCHEMBL4307940 0.89 AURKA (0.66) AURKAAURKBHDAC1CSKMAPK14
SCHEMBL14989042 0.88 AURKA (0.59) AURKAAURKBPDGFRBKDR
SCHEMBL14989132 0.88 AURKA (0.56) AURKAAURKB
SCHEMBL14989189 0.87 AURKA (0.57) AURKAAURKB
SCHEMBL14989222 0.87 AURKA (0.57) AURKAAURKBCSKTNIKPDGFRB
SCHEMBL14989004 0.86 AURKA (0.58) AURKAAURKBCSKTNIKPDGFRB

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-1847532-B1 IGF-1R INHIBITOR KYOWA HAKKO KIRIN CO LTD (JP) 2013-06-05 — — EP claimed
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