SCHEMBL21158978

SCHEMBL21158978

CCCn1c(NC)nc2cc(C(N)=O)cc(OCCC3(C)COC3)c21

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 0.51

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
SCHEMBL28553317 0.84 STING1 (0.76) STING1
SCHEMBL22136003 0.79 STING1 (0.66) STING1
SCHEMBL22136292 0.77 STING1 (0.61) STING1
SCHEMBL22857830 0.74 STING1 (0.46) STING1
SCHEMBL19448954 0.74 STING1 (0.62) STING1
SCHEMBL22121402 0.73 STING1 (0.54) STING1
SCHEMBL23637130 0.72 STING1 (0.60) STING1
SCHEMBL19449010 0.71 STING1 (0.55) STING1
SCHEMBL22136233 0.70 STING1 (0.68) STING1
SCHEMBL22121410 0.70 STING1 (0.70) 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
WO-2019134707-A1 IMMUNOMODULATOR 成都先导药物开发股份有限公司 2019-07-11 WO disclosed