SCHEMBL25925430

SCHEMBL25925430

COC(=O)c1ccc2c(C(N)=O)nn(CC(C)=O)c2c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CFD P00746 15/20 0.49
▸ GAA P10253 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ APOBEC3A P31941 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ HSD17B10 Q99714 1/20 0.37
▸ APOBEC3G Q9HC16 1/20 0.37

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
SCHEMBL29781890 0.90 CFD (0.49) CFDKDM4ELMNATSHRALDH1A1
SCHEMBL18953425 0.90 CFD (0.49) CFDKDM4ELMNATSHRALDH1A1
SCHEMBL25926111 0.87 CFD (0.39) CFD
SCHEMBL29781573 0.85 CFD (0.46) CFD
SCHEMBL19208651 0.85 CFD (0.46) CFD
SCHEMBL25925436 0.82 GAA (0.40) CFDGAARAB9AKDM4ELMNA
SCHEMBL12480012 0.81 CFD (0.48) CFDGAARAB9AKDM4ELMNA
SCHEMBL29781834 0.81 CFD (0.51) CFDGAARAB9AKDM4ELMNA
SCHEMBL17023541 0.81 CFD (0.51) CFDGAARAB9AKDM4ELMNA
SCHEMBL25925405 0.80 CFD (0.42) CFDGAARAB9AKDM4ELMNA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230218578-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-07-13 — — 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 (1 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-20230218578-A1 BENZOPYRAZOLE COMPOUNDS AND ANALOGUES THEREOF C9, C5, C1QBP CFD 13/4885GAA 641/4885RAB9A 3427/4885

“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.

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