SCHEMBL5867008

SCHEMBL5867008

CCC(CC)n1nnc2c(Sc3c(C)cc(C)cc3C)nc(C)cc21

nearest known ligand 0.47

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 5/20 0.47
HCAR3 P49019 1/20 0.34

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
SCHEMBL5866990 0.78 CRHR1 (0.66) CRHR1
SCHEMBL5866781 0.77 CRHR1 (0.48) CRHR1
SCHEMBL7216722 0.74 CRHR1 (0.54) CRHR1HCAR3
SCHEMBL7218772 0.66 CRHR1 (0.58) CRHR1
SCHEMBL7218775 0.66 CRHR1 (0.58) CRHR1
SCHEMBL5844779 0.65 CRHR1 (0.57) CRHR1
SCHEMBL5843292 0.65 CRHR1 (0.59) CRHR1
SCHEMBL7224230 0.65 CRHR1 (0.85) CRHR1
SCHEMBL7629851 0.64 CRHR1 (0.44) CRHR1
SCHEMBL16606730 0.64 CRHR1 (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6992188-B1 Substituted heterocyclic derivatives PFIZER, INC. (US) 2006-01-31 US disclosed
EP-0778277-B1 Substituted heterocyclic derivatives as CRF antagonists PFIZER (US) 2003-06-25 EP disclosed
EP-0778277-A1 Substituted heterocyclic derivatives as CRF antagonists PFIZER INC. (US) 1997-06-11 EP disclosed