SCHEMBL4689715

SCHEMBL4689715

CCCCCc1cc(C)nn2c(-c3c(C)sc4c(CCOC)cccc34)c(C)nc12

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 2/20 0.31
TLR8 Q9NR97 4/20 0.31
DCTPP1 Q9H773 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
SCHEMBL4689722 0.89 CRHR1 (0.32) CRHR1TLR8DCTPP1
SCHEMBL4689714 0.84 CRHR1 (0.47) CRHR1
SCHEMBL4694246 0.84 CRHR1 (0.32) CRHR1TLR8DCTPP1
SCHEMBL4689719 0.73 CRHR1 (0.49) CRHR1
SCHEMBL4787114 0.72 TLR8 (0.38) CRHR1TLR8
SCHEMBL4695999 0.70 CRHR1 (0.32) CRHR1TLR8
SCHEMBL4689862 0.69 CRHR1 (0.45) CRHR1
SCHEMBL4694319 0.69 CRHR1 (0.37) CRHR1TLR8DCTPP1
SCHEMBL3935197 0.68 SMPD3 (0.35) CRHR1
SCHEMBL3963105 0.68 CRHR1 (0.49) CRHR1

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
EP-1879896-A1 IMIDAZOPYRIDAZINE COMPOUNDS ELI LILLY AND COMPANY (US) 2008-01-23 EP disclosed
WO-2006107784-A1 IMIDAZOPYRIDAZINE COMPOUNDS ELI LILLY AND COMPANY (US) 2006-10-12 WO disclosed