SCHEMBL20692127

SCHEMBL20692127

N#CCCOP(=S)(OC[C@H]1C[C@@H](n2cnc3c(Cl)ncnc32)[C@@H]1CO)O[C@H]1[C@H](F)[C@H](n2ccc3c(Cl)ncnc32)O[C@@H]1CO

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 1/20 0.33
▸ SLC29A1 Q99808 5/20 0.32
▸ DNPH1 O43598 3/20 0.32
▸ METTL3 Q86U44 1/20 0.31
▸ NT5E P21589 1/20 0.31

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
SCHEMBL22349173 1.00 TYMP (0.33) TYMPSLC29A1DNPH1METTL3NT5E
SCHEMBL20691938 0.87 HIF1A (0.33) TYMPSLC29A1
SCHEMBL21263982 0.84 TAS1R3 (0.38) TYMPSLC29A1
SCHEMBL20691457 0.82 DNPH1 (0.32) SLC29A1DNPH1
SCHEMBL20691327 0.79 SLC29A1 (0.31) SLC29A1DNPH1
SCHEMBL20692221 0.78 P2RX3 (0.36) TYMP
SCHEMBL20691298 0.77 AHCY (0.37) TYMP
SCHEMBL22349203 0.77 STING1 (0.38) TYMP
SCHEMBL24680698 0.76 DNPH1 (0.33) TYMPSLC29A1DNPH1
SCHEMBL20692131 0.76 SLC29A1 (0.35) TYMPSLC29A1METTL3

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
EP-3658565-B1 CYCLIC DINUCLEOTIDES AS ANTICANCER AGENTS BRISTOL MYERS SQUIBB CO (US) 2022-11-09 — — EP disclosed
WO-2019023459-A1 CYCLIC DINUCLEOTIDES AS ANTICANCER AGENTS BRISTOL-MYERS SQUIBB COMPANY (US) 2019-01-31 — — WO disclosed
Send feedback