SCHEMBL34461772

SCHEMBL34461772

O=c1c2c(ccn2-c2ccccc2[N+](=O)[O-])n(CCO)c2nnnn12

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 3/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ HCAR1 Q9BXC0 1/20 0.34
▸ MAPT P10636 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ ALDH1A1 P00352 6/20 0.32
▸ FAAH O00519 1/20 0.32
▸ MGLL Q99685 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TDO2 P48775 1/20 0.31
▸ MET P08581 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ RAD52 P43351 1/20 0.31
▸ TSHR P16473 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
SCHEMBL34461724 0.87 GRIK1 (0.39) HCAR1POLBALDH1A1FAAHMGLL
SCHEMBL34461790 0.87 HCAR1 (0.33) CYP1A2CYP2C19HCAR1ALDH1A1FAAH
SCHEMBL34461760 0.85 GRIA1 (0.32) HCAR1ALDH1A1MEN1KMT2A
SCHEMBL34461733 0.81 ADORA2A (0.38) CYP1A2CYP2C19HCAR1MAPTPOLB
SCHEMBL34461723 0.78 TRPA1 (0.42) CYP1A2CYP2C19MAPTPOLBALDH1A1
SCHEMBL34461734 0.69 ALDH1A1 (0.36) CYP1A2CYP2C19HCAR1MAPTALDH1A1
SCHEMBL34461744 0.69 ALDH1A1 (0.37) CYP1A2CYP2C19ALDH1A1CYP3A4CYP2C9
SCHEMBL34461729 0.68 ALDH1A1 (0.35) ALDH1A1KMT2A
SCHEMBL34461739 0.65 TRPA1 (0.43) MAPTPOLBALDH1A1MEN1KMT2A
SCHEMBL5661381 0.59 ALDH1A1 (0.44) HCAR1ALDH1A1FAAHMGLLKMT2A

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-20260098041-A1 FUSED BICYCLIC PYRIMIDONES AS WRN INHIBITORS INCYTE CORPORATION (US) 2026-04-09 — — 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-20260098041-A1 FUSED BICYCLIC PYRIMIDONES AS WRN INHIBITORS WRN, POLR1A, REV1 CYP1A2 3621/4885CYP2C19 3664/4885HCAR1 848/4885

“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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