SCHEMBL21232923

SCHEMBL21232923

CC1OC(n2cnc3c(=O)[nH]c(N)nc32)C(C)C1O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HINT1 P49773 4/20 0.56
▸ STING1 Q86WV6 4/20 0.55
▸ PDE3B Q13370 1/20 0.55
▸ PDE3A Q14432 1/20 0.55
▸ NT5E P21589 1/20 0.53
▸ TAAR1 Q96RJ0 1/20 0.52
▸ ADORA3 P0DMS8 2/20 0.51
▸ GSK3A P49840 2/20 0.50
▸ RPS6KA3 P51812 2/20 0.50
▸ MAPK14 Q16539 2/20 0.50
▸ TGM2 P21980 1/20 0.49

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
SCHEMBL4278130 0.92 HINT1 (0.62) HINT1STING1PDE3BPDE3ANT5E
SCHEMBL19938159 0.92 HINT1 (0.62) HINT1STING1PDE3BPDE3ANT5E
SCHEMBL2510562 0.92 HINT1 (0.62) HINT1STING1PDE3BPDE3ANT5E
SCHEMBL16114092 0.92 HINT1 (0.62) HINT1STING1PDE3BPDE3ANT5E
SCHEMBL13833323 0.92 HINT1 (0.62) HINT1STING1PDE3BPDE3ANT5E
SCHEMBL24299397 0.92 HINT1 (0.62) HINT1STING1PDE3BPDE3ANT5E
SCHEMBL27221934 0.91 HINT1 (0.61) HINT1STING1PDE3BPDE3ANT5E
Phosphoric Acid SCHEMBL25402859 0.88 NT5E (0.63) HINT1STING1PDE3BPDE3ANT5E
Phosphoric Acid SCHEMBL1299515 0.88 NT5E (0.63) HINT1STING1PDE3BPDE3ANT5E
SCHEMBL412371 0.87 HPGD (0.62) HINT1STING1PDE3BPDE3ANT5E

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
EP-3521297-A1 MODIFIED FLUORINATED NUCLEOSIDE ANALOGUES Gilead Pharmasset LLC (US) 2019-08-07 — — EP disclosed
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