SCHEMBL29899007

SCHEMBL29899007

CCn1nc(C)cc1C(=O)Nc1nc2cc(C(N)=O)cc(OCCCO)c2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 0.65

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
Hydrochloric Acid SCHEMBL28599194 0.89 STING1 (0.55) STING1
SCHEMBL29675240 0.88 STING1 (0.63) STING1
SCHEMBL25831201 0.88 STING1 (0.63) STING1
Hydrochloric Acid SCHEMBL31066892 0.88 STING1 (0.62) STING1
SCHEMBL30412798 0.87 STING1 (0.65) STING1
SCHEMBL30803059 0.86 STING1 (0.57) STING1
SCHEMBL30605015 0.84 STING1 (0.59) STING1
SCHEMBL21789703 0.84 STING1 (0.52) STING1
Trifluoroacetic Acid SCHEMBL31113584 0.82 STING1 (0.60) STING1
SCHEMBL30734102 0.82 STING1 (0.50) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4419100-A1 ADJUVANT COMPOSITION COMPRISING STING AGONISTS GlaxoSmithKline Biologicals S.A. (BE) 2024-08-28 EP disclosed
CN-114981273-B Heterocyclic amide compound, pharmaceutically acceptable salt thereof, preparation method and application thereof 中国科学院上海药物研究所 2024-03-01 CN disclosed
WO-2023066872-A1 ADJUVANT COMPOSITION COMPRISING STING AGONISTS GLAXOSMITHKLINE BIOLOGICALS SA (BE) 2023-04-27 WO disclosed
CN-114981273-A Heterocyclic amide compound, pharmaceutically acceptable salt thereof, and preparation method and application thereof 中国科学院上海药物研究所 2022-08-30 CN disclosed