SCHEMBL29975646

SCHEMBL29975646

COCOc1cc2sc(C(=O)O)cc2cc1Br

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 16/20 0.53
PTPN2 P17706 3/20 0.46
GPR35 Q9HC97 1/20 0.45

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
SCHEMBL20562443 1.00 STING1 (0.53) STING1PTPN2GPR35
SCHEMBL31463290 0.91 PTPN2 (0.53) STING1PTPN2
SCHEMBL20562477 0.91 PTPN2 (0.53) STING1PTPN2
SCHEMBL29975798 0.85 STING1 (0.59) STING1
SCHEMBL25692520 0.85 STING1 (0.59) STING1
SCHEMBL21452623 0.85 STING1 (0.61) STING1
SCHEMBL20022261 0.84 STING1 (0.66) STING1PTPN2GPR35
SCHEMBL29636423 0.84 STING1 (0.66) STING1PTPN2GPR35
SCHEMBL21406007 0.83 STING1 (0.79) STING1
SCHEMBL21406006 0.83 STING1 (0.79) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024032782-A1 VACCINE ADJUVANTS AND USES THEREOF JACOBIO PHARMACEUTICALS CO.LTD. (CN) 2024-02-15 WO disclosed
EP-4313962-A1 NOVEL COMPOUNDS USEFUL AS STING AGONISTS AND USES THEREOF Jacobio Pharmaceuticals Co., Ltd. (CN) 2024-02-07 EP disclosed
CN-117203194-A Novel compounds useful as STING agonists and uses thereof 北京加科思新药研发有限公司 2023-12-08 CN disclosed
WO-2023109942-A1 COMPOUND-LINKER CONSTRUCTS COMPRISING NOVEL COMPOUNDS USEFUL AS STING AGONISTS AND USES THEREOF JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2023-06-22 WO disclosed
WO-2022206725-A1 NOVEL COMPOUNDS USEFUL AS STING AGONISTS AND USES THEREOF JACOBIO PHARMACEUTICALS CO., LTD. (CN) 2022-10-06 WO disclosed