SCHEMBL30765111

SCHEMBL30765111

NC(=O)c1ccc(OCc2c(C(=O)O)sc3cccc(Cl)c23)cc1Br

nearest known ligand 0.79

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 16/20 0.79
MCL1 Q07820 3/20 0.50
MAPK1 P28482 1/20 0.44
PARP15 Q460N3 1/20 0.40

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
SCHEMBL23111988 1.00 STING1 (0.79) STING1MCL1MAPK1PARP15
SCHEMBL23630799 0.88 STING1 (1.00) STING1MCL1MAPK1PARP15
SCHEMBL23635813 0.88 STING1 (0.76) STING1MCL1MAPK1PARP15
SCHEMBL30697678 0.88 STING1 (0.76) STING1MCL1MAPK1PARP15
SCHEMBL23111980 0.88 STING1 (0.65) STING1MCL1MAPK1PARP15
SCHEMBL23635804 0.87 STING1 (0.64) STING1MCL1MAPK1PARP15
SCHEMBL23635897 0.85 STING1 (0.78) STING1MCL1MAPK1PARP15
SCHEMBL23111974 0.83 STING1 (0.68) STING1MCL1MAPK1
SCHEMBL23630792 0.82 STING1 (0.67) STING1MCL1PARP15
SCHEMBL23630791 0.81 STING1 (0.65) STING1MCL1MAPK1

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-112424181-B Substituted condensed thiophenes as STING modulators 希泰克斯特私人有限公司 2024-02-27 CN disclosed