SCHEMBL21158754

SCHEMBL21158754

CCCn1c(NC(=O)c2cc(C)nn2CC)nc2cc(C(N)=O)cc(OC3CCOC3)c21

nearest known ligand 0.89

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 20/20 0.89

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
SCHEMBL21158740 0.95 STING1 (0.86) STING1
SCHEMBL21158644 0.94 STING1 (1.00) STING1
SCHEMBL21158114 0.89 STING1 (0.82) STING1
SCHEMBL28924678 0.88 STING1 (0.79) STING1
SCHEMBL28924683 0.88 STING1 (0.79) STING1
SCHEMBL21157494 0.87 STING1 (0.78) STING1
SCHEMBL21157498 0.87 STING1 (0.78) STING1
SCHEMBL21158084 0.87 STING1 (0.78) STING1
SCHEMBL21158752 0.85 STING1 (0.75) STING1
SCHEMBL21158749 0.85 STING1 (0.81) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110016021-B Immunomodulator 成都先导药物开发股份有限公司 2021-05-07 CN disclosed
WO-2019134707-A1 IMMUNOMODULATOR 成都先导药物开发股份有限公司 2019-07-11 WO disclosed