SCHEMBL22493065

SCHEMBL22493065

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

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 2/20 0.32
GRIN3B O60391 2/20 0.32
GRIN1 Q05586 2/20 0.32
GRIN2A Q12879 2/20 0.32
GRIN2B Q13224 2/20 0.32
GRIN2C Q14957 2/20 0.32
GRIN3A Q8TCU5 2/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
HSD17B10 Q99714 1/20 0.31
DAO P14920 1/20 0.30
DDO Q99489 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
SCHEMBL22493070 0.81 KDM4E (0.32) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL22493072 0.71 DAO (0.41) ALDH1A1GAADAO
SCHEMBL22118838 0.66
SCHEMBL22493268 0.65 PTGES (0.30)
SCHEMBL6648236 0.63 PARP1 (0.35) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6643243 0.63 TNKS (0.36) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL16625297 0.63 DAO (0.40) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL6649500 0.62 TNKS (0.47) KDM4EALDH1A1HSD17B10DAODDO
SCHEMBL15268562 0.62 TNKS (0.46) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL16578756 0.61 FASN (0.36) KDM4EALDH1A1DAO

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 GRIN2D 4792/4885GRIN3B 3173/4885GRIN1 4303/4885
US-11001592-B2 DNA polymerase IIIC inhibitors and use thereof POLI, POLN, POLB GRIN2D 4792/4885GRIN3B 3173/4885GRIN1 4303/4885

“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.