SCHEMBL29685013

SCHEMBL29685013

Cc1cc(C(N)=O)cc2nc(NC(=O)c3cc4ccccc4n3C)n(C/C=C/Cn3c(NC(=O)c4cc5ccccc5n4C)nc4cc(C(N)=O)ccc43)c12

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 17/20 0.49
TBK1 Q9UHD2 1/20 0.49
MAP3K7 O43318 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43

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
SCHEMBL22150267 1.00 STING1 (0.49) STING1TBK1MAP3K7NPC1RAB9A
SCHEMBL28751744 1.00 STING1 (0.49) STING1TBK1MAP3K7NPC1RAB9A
SCHEMBL28751728 0.87 STING1 (0.52) STING1TBK1
SCHEMBL22150402 0.87 STING1 (0.52) STING1TBK1
SCHEMBL29684418 0.87 STING1 (0.52) STING1TBK1
SCHEMBL22150418 0.86 STING1 (0.50) STING1TBK1
SCHEMBL22121422 0.84 STING1 (0.47) STING1TBK1MAP3K7NPC1RAB9A
SCHEMBL22151392 0.84 STING1 (0.47) STING1TBK1MAP3K7NPC1RAB9A
SCHEMBL22121425 0.84 STING1 (0.47) STING1TBK1MAP3K7NPC1RAB9A
SCHEMBL22150420 0.83 STING1 (0.49) STING1TBK1

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-4007758-A1 BIS-[N-((5-CARBAMOYL)-1H-BENZO[D]IMIDAZOL-2-YL)-PYRAZOL-5-CARBOXAMIDE] DERIVATIVES AND RELATED COMPOUNDS AS STING (STIMULATOR OF INTERFERON GENES) AGONISTS FOR THE TREATMENT OF CANCER Mersana Therapeutics, Inc. (US) 2022-06-08 EP claimed
CN-114585623-A Bis [ N- ((5-carbamoyl) -1H-benzo [ d ] imidazol-2-yl) pyrazole-5-carboxamide ] derivatives and related compounds as STING (interferon gene stimulator) agonists for the treatment of cancer 梅尔莎纳医疗公司 2022-06-03 CN claimed
EP-4007758-A1 BIS-[N-((5-CARBAMOYL)-1H-BENZO[D]IMIDAZOL-2-YL)-PYRAZOL-5-CARBOXAMIDE] DERIVATIVES AND RELATED COMPOUNDS AS STING (STIMULATOR OF INTERFERON GENES) AGONISTS FOR THE TREATMENT OF CANCER Mersana Therapeutics, Inc. (US) 2022-06-08 EP disclosed
CN-114585623-A Bis [ N- ((5-carbamoyl) -1H-benzo [ d ] imidazol-2-yl) pyrazole-5-carboxamide ] derivatives and related compounds as STING (interferon gene stimulator) agonists for the treatment of cancer 梅尔莎纳医疗公司 2022-06-03 CN disclosed