SCHEMBL21158657

SCHEMBL21158657

CCCn1c(NC(=O)c2sc(C)nc2CC)nc2cc(C(N)=O)cc(OCCC3COC3)c21

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 0.62

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
SCHEMBL21158989 0.88 STING1 (0.69) STING1
SCHEMBL21158660 0.87 STING1 (0.63) STING1
SCHEMBL21158735 0.86 STING1 (0.60) STING1
SCHEMBL21158742 0.86 STING1 (0.57) STING1
SCHEMBL21158741 0.84 STING1 (0.59) STING1
SCHEMBL21158755 0.82 STING1 (0.78) STING1
SCHEMBL21158745 0.80 STING1 (0.66) STING1
SCHEMBL21158728 0.80 STING1 (0.69) STING1
SCHEMBL21158785 0.79 STING1 (0.48) STING1
SCHEMBL21158739 0.79 STING1 (0.65) 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