SCHEMBL22118974

SCHEMBL22118974

CNC(COC)COC(Cc1nc2c[nH]nc2c(=O)[nH]1)NCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 1/20 0.33
▸ RNASEH1 O60930 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ FOXO1 Q12778 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
SCHEMBL22118872 0.86 TSHR (0.36) PNPRNASEH1ALDH1A1TSHRMEN1
SCHEMBL22118854 0.85 RNASEH1 (0.34) PNPRNASEH1
SCHEMBL22119381 0.85 RNASEH1 (0.34) PNPRNASEH1
Hydrochloric Acid SCHEMBL22119087 0.83 PNP (0.32) PNPRNASEH1
SCHEMBL22118865 0.83 PNP (0.33) PNP
SCHEMBL22118859 0.83 RNASEH1 (0.33) PNPRNASEH1
SCHEMBL22118816 0.82 PNP (0.31) PNP
SCHEMBL22118896 0.79 PNP (0.31) PNPRNASEH1
SCHEMBL22118878 0.79 SIGMAR1 (0.39) ALDH1A1TSHR
SCHEMBL22118809 0.78 RNASEH1 (0.33) PNPRNASEH1

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-3897645-A1 DNA POLYMERASE IIIC INHIBITORS AND USE THEREOF Acurx Pharmaceuticals, LLC (US) 2021-10-27 — — EP disclosed
WO-2020132174-A1 DNA POLYMERASE IIIC INHIBITORS AND USE THEREOF ACURX PHARMACEUTICALS, LLC (US) 2020-06-25 — — WO disclosed
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