SCHEMBL22118872

SCHEMBL22118872

CO[C@@H](Cc1nc2c[nH]nc2c(=O)[nH]1)NCc1ccc(Cl)c(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ PNP P00491 1/20 0.35
▸ FOXO1 Q12778 1/20 0.35
▸ RNASEH1 O60930 1/20 0.34

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
SCHEMBL22118854 0.87 RNASEH1 (0.34) PNPRNASEH1
SCHEMBL22119381 0.87 RNASEH1 (0.34) PNPRNASEH1
SCHEMBL22118974 0.86 PNP (0.33) TSHRALDH1A1MEN1KMT2APNP
Hydrochloric Acid SCHEMBL22119087 0.86 PNP (0.32) PNPRNASEH1
SCHEMBL22118865 0.86 PNP (0.33) PNP
SCHEMBL22118859 0.85 RNASEH1 (0.33) PNPRNASEH1
SCHEMBL22118907 0.85 ALDH1A1 (0.31) ALDH1A1PNPFOXO1RNASEH1
SCHEMBL22118816 0.84 PNP (0.31) PNP
SCHEMBL22118896 0.83 PNP (0.31) PNPRNASEH1
SCHEMBL22119321 0.81 PNP (0.40) ALDH1A1PNPRNASEH1

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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