SCHEMBL28751947

SCHEMBL28751947

NC(=O)c1ccc2c(c1)nc(N)n2CC=CCn1c(N)nc2cc(C(N)=O)cc(OCCCO)c21

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ STING1 Q86WV6 19/20 0.50
▸ JAK2 O60674 1/20 0.43
▸ JAK1 P23458 1/20 0.43
▸ TYK2 P29597 1/20 0.43
▸ JAK3 P52333 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
SCHEMBL22937441 1.00 STING1 (0.50) STING1JAK2JAK1TYK2JAK3
SCHEMBL29689511 1.00 STING1 (0.50) STING1JAK2JAK1TYK2JAK3
SCHEMBL22121384 0.87 STING1 (0.63) STING1
SCHEMBL28941702 0.87 STING1 (0.63) STING1
SCHEMBL30823045 0.84 STING1 (0.56) STING1
SCHEMBL23077417 0.84 STING1 (0.53) STING1
SCHEMBL23077419 0.84 STING1 (0.53) STING1
SCHEMBL22121185 0.83 STING1 (0.60) STING1
SCHEMBL19451513 0.82 STING1 (0.80) STING1
SCHEMBL22121390 0.82 STING1 (0.57) 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-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
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