SCHEMBL388670

SCHEMBL388670

O=C(O)n1ncc2cc(CCl)c(F)cc21

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMO O15229 10/20 0.38
MAPT P10636 1/20 0.33
CHEK1 O14757 1/20 0.33
AURKA O14965 1/20 0.33
DAPK3 O43293 1/20 0.33
CSNK1A1 P48729 1/20 0.33
GSK3A P49840 1/20 0.33
LIMK1 P53667 1/20 0.33
IKBKE Q14164 1/20 0.33
MAPK14 Q16539 1/20 0.33
TAOK1 Q7L7X3 1/20 0.33
CLK4 Q9HAZ1 1/20 0.33
DYRK1B Q9Y463 1/20 0.33
KMT2A Q03164 1/20 0.32
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
MET P08581 2/20 0.31
SLC22A12 Q96S37 2/20 0.31
ASAH1 Q13510 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
SCHEMBL388627 0.87 CHEK1 (0.34) KMOMAPTCHEK1AURKADAPK3
SCHEMBL3515408 0.77 CHEK1 (0.42) KMOMAPTCHEK1AURKADAPK3
SCHEMBL3710758 0.75 ERN1 (0.34) KMOMAPTCHEK1AURKADAPK3
SCHEMBL29804021 0.68 KMT2A (0.44) KMOMAPTCHEK1AURKADAPK3
SCHEMBL18168026 0.68 CHEK1 (0.45) KMOMAPTCHEK1AURKADAPK3
SCHEMBL20791823 0.68 SLC22A12 (0.38) KMOMAPTCHEK1AURKADAPK3
SCHEMBL29241416 0.68 CHEK1 (0.49) MAPTCHEK1AURKADAPK3CSNK1A1
SCHEMBL12058336 0.67 EGFR (0.41) CHEK1AURKADAPK3CSNK1A1GSK3A
SCHEMBL17847964 0.67 CCR9 (0.39) KMOMAPTCHEK1AURKADAPK3
SCHEMBL31691580 0.65 CHEK1 (0.49) KMOMAPTCHEK1AURKADAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2408761-A1 SUBSTITUTED INDOLE DERIVATIVES AND METHODS OF USE THEREOF Schering Corporation (US) 2012-01-25 EP disclosed
CN-102159579-A Tricyclic indole derivatives and methods of use thereof SCHERING CORP 2011-08-17 CN disclosed
CN-101842376-A Tetracyclic indole derivatives and being used for the treatment of or prophylaxis of viral infections SCHERING CORP 2010-09-22 CN disclosed
CN-101842374-A 2, 3-substituted azaindole derivatives for the treatment of viral infections SCHERING CORP 2010-09-22 CN disclosed
WO-2009032124-A1 SUBSTITUTED INDOLE DERIVATIVES AND METHODS OF USE THEREOF SCHERING CORPORATION (US) 2009-03-12 WO disclosed