SCHEMBL25792230

SCHEMBL25792230

Cc1c[nH]c(=O)n(CCc2ccc([N+](=O)[O-])cc2)c1=O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KCNJ1 P48048 10/20 0.48
▸ KCNH2 Q12809 9/20 0.48
▸ HRH3 Q9Y5N1 3/20 0.46
▸ KMT2A Q03164 3/20 0.42
▸ P2RX4 Q99571 1/20 0.42
▸ CYP19A1 P11511 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MAOA P21397 1/20 0.41
▸ L3MBTL1 Q9Y468 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
SCHEMBL15110502 0.71 SLC9A1 (0.51) —
SCHEMBL28676104 0.70 P2RX4 (0.50) KMT2AP2RX4MEN1L3MBTL1
SCHEMBL4171496 0.70 P2RX4 (0.50) KMT2AP2RX4MEN1L3MBTL1
SCHEMBL17241980 0.69 MAPT (0.52) KMT2AMEN1
SCHEMBL12990649 0.69 CA12 (0.50) KCNJ1KCNH2KMT2AMEN1
SCHEMBL6493969 0.68 HRH3 (0.52) KCNJ1KCNH2HRH3KMT2AMEN1
SCHEMBL6926451 0.68 SLC9A1 (0.52) L3MBTL1
SCHEMBL16581427 0.67 ADORA2A (0.48) L3MBTL1
SCHEMBL3292782 0.67 TSHR (0.75) KCNJ1KCNH2HRH3TSHR
SCHEMBL4772758 0.67 ADORA2B (0.50) KMT2ATSHRMEN1L3MBTL1

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-20230212212-A1 PROCESSES FOR PREPARING OLIGONUCLEOTIDES SHANGHAI STA PHARMACEUTICAL R&D CO., LTD. (CN) 2023-07-06 — — 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-20230212212-A1 PROCESSES FOR PREPARING OLIGONUCLEOTIDES XRN2, UPF1, NSUN2 KCNJ1 3467/4885KCNH2 3744/4885HRH3 2953/4885

“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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