SCHEMBL31345686

SCHEMBL31345686

Cc1ccc(C(C)(C)C)cc1N1CCc2nn(-c3c(C)cccc3OCC(C)C)c(-c3ccc(C(N)=O)cc3)c2C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
C5AR1 P21730 20/20 1.00

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
SCHEMBL21074086 1.00 C5AR1 (1.00) C5AR1
SCHEMBL21131981 0.94 C5AR1 (0.88) C5AR1
SCHEMBL21139876 0.92 C5AR1 (1.00) C5AR1
SCHEMBL21137585 0.91 C5AR1 (0.89) C5AR1
SCHEMBL21137561 0.91 C5AR1 (1.00) C5AR1
SCHEMBL21139882 0.89 C5AR1 (1.00) C5AR1
SCHEMBL21074088 0.87 C5AR1 (0.83) C5AR1
SCHEMBL31345685 0.87 C5AR1 (0.83) C5AR1
SCHEMBL21139879 0.85 C5AR1 (0.83) C5AR1
SCHEMBL21139609 0.85 C5AR1 (0.92) 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