SCHEMBL25073993

SCHEMBL25073993

CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)cc(OC)c2n1C/C=C/Cn1c(NC(=O)c2cc(C)nn2CC)nc2cc(C)cc(OCCCOP(O)O)c21

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 0.80
CYP3A4 P08684 1/20 0.71

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
SCHEMBL20889143 0.92 STING1 (0.94) STING1CYP3A4
SCHEMBL24467473 0.91 STING1 (0.90) STING1CYP3A4
SCHEMBL24467481 0.90 STING1 (0.81) STING1CYP3A4
SCHEMBL20886134 0.89 STING1 (0.90) STING1CYP3A4
SCHEMBL23637235 0.89 STING1 (0.76) STING1CYP3A4
SCHEMBL30206875 0.89 STING1 (1.00) STING1CYP3A4
SCHEMBL29626047 0.89 STING1 (1.00) STING1CYP3A4
SCHEMBL23327842 0.89 STING1 (1.00) STING1CYP3A4
SCHEMBL28614917 0.89 STING1 (1.00) STING1CYP3A4
SCHEMBL19451558 0.89 STING1 (1.00) STING1CYP3A4

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
WO-2023020992-A1 NOVEL METHODS GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2023-02-23 WO disclosed
WO-2023020994-A1 NOVEL METHODS GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2023-02-23 WO disclosed