SCHEMBL34461736

SCHEMBL34461736

O=C(Cn1c2cc[nH]c2c(=O)n2c(-c3ccccc3[N+](=O)[O-])nnc12)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ HTT P42858 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ THRB P10828 1/20 0.37
▸ AKR1B1 P15121 1/20 0.37
▸ KDR P35968 2/20 0.36
▸ KAT2B Q92831 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ BCHE P06276 1/20 0.35
▸ ENPP2 Q13822 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ TRPA1 O75762 1/20 0.34

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
SCHEMBL34461731 0.87 KDM4E (0.39) POLBKDM4EAKR1B1MAPTBCHE
SCHEMBL34461735 0.84 TRPA1 (0.42) MEN1KMT2AALDH1A1POLBCYP1A2
SCHEMBL34461704 0.83 TGM2 (0.38) POLBKDM4EAKR1B1MAPTADORA2A
SCHEMBL34461745 0.83 ADORA2A (0.41) MEN1KMT2AALDH1A1MAPTADORA2A
SCHEMBL34461705 0.78 ADORA2A (0.46) MEN1KMT2AALDH1A1POLBHTT
SCHEMBL34461787 0.77 ADORA2A (0.42) MEN1KMT2AALDH1A1MAPTADORA2A
SCHEMBL34461722 0.74 TRPA1 (0.43) MEN1KMT2AALDH1A1POLBCYP1A2
SCHEMBL34461749 0.72 ADORA2A (0.41) MEN1KMT2AALDH1A1MAPTADORA2A
SCHEMBL34461762 0.71 TRPA1 (0.45) MEN1KMT2AALDH1A1KDM4EAKR1B1
SCHEMBL31678122 0.70 KMT2A (0.38) MEN1KMT2AALDH1A1POLBCYP1A2

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 MEN1 897/4885KMT2A 3313/4885ALDH1A1 1354/4885

“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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