SCHEMBL7740292

SCHEMBL7740292

C/N=C1/C(=O)Nc2ccccc21

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 9/20 0.62
IDO1 P14902 3/20 0.62
AGTR1 P30556 3/20 0.60
POLB P06746 1/20 0.60
TDO2 P48775 1/20 0.60
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
GALR3 O60755 1/20 0.56
ALDH1A1 P00352 1/20 0.55
TTR P02766 1/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
MAOA P21397 1/20 0.55
MAOB P27338 1/20 0.55
PDGFRA P16234 1/20 0.55
FER P16591 1/20 0.55
LTK P29376 1/20 0.55
CDK8 P49336 1/20 0.55
ACVR1 Q04771 1/20 0.55
DYRK1B Q9Y463 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
SCHEMBL14405656 1.00 LRRK2 (0.62) LRRK2IDO1AGTR1POLBTDO2
SCHEMBL12804786 0.83 LRRK2 (0.67) LRRK2IDO1AGTR1POLBTDO2
SCHEMBL12971379 0.83 LRRK2 (0.67) LRRK2IDO1AGTR1POLBTDO2
SCHEMBL12804785 0.83 LRRK2 (0.67) LRRK2IDO1AGTR1POLBTDO2
SCHEMBL16760895 0.80 LRRK2 (0.62) LRRK2IDO1AGTR1POLBTDO2
SCHEMBL3613979 0.80 LRRK2 (0.62) LRRK2IDO1AGTR1POLBTDO2
SCHEMBL3544607 0.80 LRRK2 (0.62) LRRK2IDO1AGTR1POLBTDO2
SCHEMBL5740660 0.80 LRRK2 (0.62) LRRK2IDO1AGTR1POLBTDO2
SCHEMBL1898719 0.80 LRRK2 (0.62) LRRK2IDO1AGTR1POLBTDO2
SCHEMBL1898716 0.80 LRRK2 (0.62) LRRK2IDO1AGTR1POLBTDO2

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
US-6774134-B2 FOR THERAPY OF RESPIRATORY SYNCYTIAL VIRUS INFECTION BRISTOL-MYERS SQUIBB COMPANY 2004-08-10 US disclosed