SCHEMBL5265469

SCHEMBL5265469

Cc1ccsc1C(=O)Nc1cc(N2CCN(C(=O)O)CC2)ccc1C=Cc1n[nH]c2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 6/20 0.60
AURKB Q96GD4 5/20 0.60
GFER P55789 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
FLT3 P36888 2/20 0.38
MAPT P10636 4/20 0.37
LMNA P02545 3/20 0.37
MEN1 O00255 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 1/20 0.37
ATM Q13315 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
POLB P06746 2/20 0.37
ALDH1A1 P00352 1/20 0.37
INSR P06213 4/20 0.36
ALK Q9UM73 4/20 0.36
FGFR1 P11362 2/20 0.36

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
SCHEMBL4320733 0.94 AURKA (0.60) AURKAAURKBGFERNPC1RAB9A
SCHEMBL4320741 0.94 AURKA (0.60) AURKAAURKBGFERNPC1RAB9A
SCHEMBL4314913 0.93 AURKA (0.58) AURKAAURKBGFERNPC1RAB9A
SCHEMBL4314905 0.93 AURKA (0.58) AURKAAURKBGFERNPC1RAB9A
SCHEMBL4326949 0.91 AURKA (0.58) AURKAAURKBGFERNPC1RAB9A
SCHEMBL4326955 0.91 AURKA (0.58) AURKAAURKBGFERNPC1RAB9A
SCHEMBL4316361 0.90 AURKA (0.56) AURKAAURKBNPC1RAB9AFLT3
SCHEMBL4316358 0.90 AURKA (0.56) AURKAAURKBNPC1RAB9AFLT3
SCHEMBL4315080 0.89 AURKA (0.59) AURKAAURKBGFERNPC1RAB9A
SCHEMBL4313589 0.89 AURKA (0.60) AURKAAURKBGFERNPC1RAB9A

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-A1 IGF-1R INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-10-24 EP disclosed