SCHEMBL29200513

SCHEMBL29200513

CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)cc(OCC3COC3)c2n1CCCOC(=O)NC(C)(C)C

nearest known ligand 0.63

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 0.63

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
SCHEMBL29200511 0.89 STING1 (0.76) STING1
SCHEMBL29200498 0.89 STING1 (0.70) STING1
SCHEMBL21158749 0.88 STING1 (0.81) STING1
SCHEMBL21158755 0.82 STING1 (0.78) STING1
SCHEMBL29200628 0.82 STING1 (0.70) STING1
SCHEMBL21157497 0.82 STING1 (0.76) STING1
SCHEMBL21158653 0.81 STING1 (0.78) STING1
SCHEMBL21158655 0.79 STING1 (0.74) STING1
SCHEMBL22135380 0.79 STING1 (0.82) STING1
SCHEMBL21156983 0.79 STING1 (0.73) STING1

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-117658992-A Benzimidazole compound, preparation method and pharmaceutical application thereof 中国医学科学院药物研究所 2024-03-08 CN disclosed