SCHEMBL22119110

SCHEMBL22119110

O=c1[nH]c(C[C@@H](NCc2ccc(Cl)c(Cl)c2)Oc2ccc(CO)nc2)nc2c[nH]nc12

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 2/20 0.31
▸ ADORA2B P29275 1/20 0.31
▸ ADORA1 P30542 1/20 0.31
▸ RNASEH1 O60930 1/20 0.31
▸ PNP P00491 1/20 0.30

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 0.81 RNASEH1 (0.34) RNASEH1PNP
SCHEMBL22119381 0.81 RNASEH1 (0.34) RNASEH1PNP
SCHEMBL22118872 0.81 TSHR (0.36) RNASEH1PNP
SCHEMBL22118859 0.80 RNASEH1 (0.33) RNASEH1PNP
SCHEMBL22119032 0.79 KDM5B (0.31) —
SCHEMBL22119310 0.76 RNASEH1 (0.34) RNASEH1PNP
SCHEMBL22118821 0.76 MAPT (0.34) RNASEH1PNP
Hydrochloric Acid SCHEMBL22119087 0.76 PNP (0.32) RNASEH1PNP
SCHEMBL22118865 0.76 PNP (0.33) ADORA2BADORA1PNP
SCHEMBL22118809 0.75 RNASEH1 (0.33) RNASEH1PNP

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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