SCHEMBL31345673

SCHEMBL31345673

CCc1cccc(CC)c1-n1nc2c(c1-c1cc(F)c(N)cc1F)CN(C(=O)OC(C)(C)C)C(C)(C)C2

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 20/20 0.57

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
SCHEMBL21074124 1.00 C5AR1 (0.57) C5AR1
SCHEMBL21074123 0.89 C5AR1 (0.74) C5AR1
SCHEMBL31345705 0.89 C5AR1 (0.74) C5AR1
SCHEMBL28480803 0.88 C5AR1 (0.62) C5AR1
SCHEMBL21074076 0.88 C5AR1 (0.54) C5AR1
SCHEMBL31345667 0.88 C5AR1 (0.54) C5AR1
SCHEMBL21067066 0.87 C5AR1 (0.61) C5AR1
SCHEMBL30640049 0.87 C5AR1 (0.61) C5AR1
SCHEMBL31345650 0.84 C5AR1 (0.60) C5AR1
SCHEMBL21074127 0.84 C5AR1 (0.60) C5AR1

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
CN-111788185-B Diaryl substituted 6,5 fused ring compounds as C5a inhibitors 凯莫森特里克斯股份有限公司 2024-12-13 CN disclosed