SCHEMBL22493070

SCHEMBL22493070

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

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
GRIN2D O15399 2/20 0.32
GRIN3B O60391 2/20 0.32
ALDH1A1 P00352 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
HSD17B10 Q99714 2/20 0.32
GAA P10253 1/20 0.32
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
TSHR P16473 1/20 0.30
THPO P40225 1/20 0.30
GRIA1 P42261 1/20 0.30
GRIA2 P42262 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
SCHEMBL22493065 0.81 GRIN2D (0.32) KDM4EGRIN2DGRIN3BALDH1A1GRIN1
SCHEMBL31469880 0.69 CHUK (0.40) KDM4EGRIN2DGRIN3BALDH1A1GRIN1
SCHEMBL31469873 0.69 CHUK (0.40) KDM4EGRIN2DGRIN3BALDH1A1GRIN1
SCHEMBL22493073 0.69 DAO (0.42) ALDH1A1GAATSHR
SCHEMBL22119341 0.63 PNP (0.32)
SCHEMBL24800370 0.62 PIM1 (0.35) KDM4EGRIN2DGRIN3BALDH1A1GRIN1
SCHEMBL25226425 0.61 CCR8 (0.42) ALDH1A1KMT2A
SCHEMBL1921269 0.61 ACHE (0.44) ALDH1A1HSD17B10HPGDBLMSMN1; SMN2
SCHEMBL6646830 0.61 PARP1 (0.46) KDM4EGRIN2DGRIN3BALDH1A1GRIN1
SCHEMBL599352 0.61 NPSR1 (0.57) KDM4EALDH1A1HSD17B10GAALMNA

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 KDM4E 3100/4885GRIN2D 4792/4885GRIN3B 3173/4885
US-11001592-B2 DNA polymerase IIIC inhibitors and use thereof POLI, POLN, POLB KDM4E 3100/4885GRIN2D 4792/4885GRIN3B 3173/4885

“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.