SCHEMBL22193777

SCHEMBL22193777

C=C1C(COP(=O)(O)OC2C(O)C(COP(=O)(O)O)OC2n2cnc3c(=O)[nH]c(N)nc32)OC1n1cnc2c(=O)[nH]c(N)nc21

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RNASEL Q05823 6/20 0.59
▸ TAS1R3 Q7RTX0 1/20 0.59
▸ TAS1R1 Q7RTX1 1/20 0.59
▸ TGM2 P21980 1/20 0.58
▸ NT5E P21589 1/20 0.58
▸ FUT5 Q11128 1/20 0.55
▸ IMPDH2 P12268 2/20 0.54
▸ KRAS P01116 2/20 0.54

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
SCHEMBL22193779 0.95 RNASEL (0.67) RNASEL
SCHEMBL2315645 0.87 NT5E (0.69) RNASELTAS1R3TAS1R1TGM2NT5E
SCHEMBL31310507 0.86 TAS1R3 (0.67) RNASELTAS1R3TAS1R1TGM2NT5E
SCHEMBL23635808 0.85 RNASEL (0.79) RNASEL
SCHEMBL18320601 0.84 NT5E (0.72) RNASELTAS1R3TAS1R1TGM2NT5E
SCHEMBL23430070 0.84 RNASEL (0.82) RNASEL
SCHEMBL21140197 0.84 RNASEL (0.82) RNASEL
SCHEMBL23430015 0.84 RNASEL (0.82) RNASEL
SCHEMBL23430014 0.84 RNASEL (0.82) RNASEL
SCHEMBL23752167 0.84 TGM2 (0.70) RNASELTAS1R3TAS1R1TGM2NT5E

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
WO-2021141862-A1 METHODS OF MODULATING STING PATHWAY ACTIVATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-07-15 — — WO disclosed
EP-2992000-B1 CYCLIC DI-NUCLEOTIDE INDUCTION OF TYPE I INTERFERON UNIV CALIFORNIA (US) 2020-07-08 — — EP disclosed
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