SCHEMBL11539161

SCHEMBL11539161

CCCCNc1nc(C(C)C)co1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.38
TLR8 Q9NR97 6/20 0.34
TLR7 Q9NYK1 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
BCHE P06276 1/20 0.33
TRPC3 Q13507 1/20 0.33
TRPC4 Q9UBN4 1/20 0.33
TRPC5 Q9UL62 1/20 0.33
CCNB2 O95067 1/20 0.31
CDK1 P06493 1/20 0.31
CCNB1 P14635 1/20 0.31
CCNB3 Q8WWL7 1/20 0.31
CYP1A2 P05177 1/20 0.31
SLC29A1 Q99808 1/20 0.31

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
SCHEMBL11363510 0.77 TLR8 (0.44) ELANETLR8TLR7KDM4ENPSR1
SCHEMBL11539177 0.73 ELANE (0.38) ELANETLR8TLR7KDM4ENPSR1
SCHEMBL11535323 0.72 ELANE (0.43) ELANETLR8
SCHEMBL20833367 0.72
SCHEMBL11539500 0.71 DNM2 (0.44) ELANETLR8NPSR1
SCHEMBL11539785 0.70 TLR8 (0.51) ELANETLR8KDM4ENPSR1L3MBTL1
SCHEMBL21700132 0.67 ELANE (0.43) ELANE
SCHEMBL1527329 0.66 ELANE (0.45) ELANEKDM4E
SCHEMBL11537211 0.66 ELANE (0.39) ELANETLR8KDM4ECYP1A2
SCHEMBL17995536 0.66 ESR1 (0.53) TLR8KDM4ESLC29A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4150143-A N-Substituted-acylamino-oxazoles as antiasthma agents LILLY INDUSTRIES LIMITED (GB) 1979-04-17 US disclosed
US-4122183-A ANTIASTHMATIC LILLY INDUSTRIES LIMITED (GB) 1978-10-24 US disclosed