SCHEMBL22493073

SCHEMBL22493073

O=c1[nH]c(NCc2ccc(Cl)c(Cl)c2)cc2c(Cl)n[nH]c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.42
ALDH1A1 P00352 1/20 0.42
CHEK1 O14757 1/20 0.41
ROCK2 O75116 1/20 0.41
RPS6KA5 O75582 1/20 0.41
MAP4K4 O95819 1/20 0.41
CHEK2 O96017 1/20 0.41
PIM1 P11309 1/20 0.41
PRKACA P17612 1/20 0.41
RPS6KB1 P23443 1/20 0.41
MAPK1 P28482 1/20 0.41
AKT1 P31749 1/20 0.41
AKT2 P31751 1/20 0.41
CLK2 P49760 1/20 0.41
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
RPS6KA3 P51812 1/20 0.41
PRKX P51817 1/20 0.41
NEK4 P51957 1/20 0.41
CSNK1G2 P78368 1/20 0.41

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
SCHEMBL22493072 0.88 DAO (0.41) DAOALDH1A1CHEK1ROCK2RPS6KA5
SCHEMBL22119085 0.78 CLPP (0.48)
SCHEMBL30468589 0.72 GPR84 (0.57) ALDH1A1
SCHEMBL30468590 0.72 GPR84 (0.57) ALDH1A1
SCHEMBL22493058 0.72 GAA (0.46) GAA
SCHEMBL29541105 0.71 CLPP (0.46)
SCHEMBL22119024 0.71 CLPP (0.46)
SCHEMBL22119317 0.69 CLPP (0.47)
SCHEMBL22493070 0.69 KDM4E (0.32) ALDH1A1GAATSHR
SCHEMBL22493068 0.69 GAA (0.43) GAA

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
US-11001592-B2 DNA polymerase IIIC inhibitors and use thereof ACURX PHARMACEUTICALS, LLC (US) 2021-05-11 US disclosed
US-20200308179-A1 DNA Polymerase IIIC Inhibitors and Use Thereof Acurx Pharmaceuticals, Inc. 2020-10-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200308179-A1 DNA Polymerase IIIC Inhibitors and Use Thereof POLI, POLN, POLB DAO 1494/4885ALDH1A1 3055/4885CHEK1 1125/4885
US-11001592-B2 DNA polymerase IIIC inhibitors and use thereof POLI, POLN, POLB DAO 1494/4885ALDH1A1 3055/4885CHEK1 1125/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.