SCHEMBL25135345

SCHEMBL25135345

CCOC(C)(C)CCOC(=O)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR2A P28223 1/20 0.49
▸ BCL9 O00512 1/20 0.49
▸ CTNNB1 P35222 1/20 0.49
▸ GAA P10253 1/20 0.45
▸ MAPT P10636 4/20 0.44
▸ CRHBP P24387 1/20 0.44
▸ CRHR2 Q13324 1/20 0.44
▸ MGLL Q99685 2/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ KMT2A Q03164 3/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ MAOB P27338 1/20 0.41
▸ NR1H4 Q96RI1 1/20 0.41
▸ NPC1 O15118 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
SCHEMBL14780819 0.90 HTR2A (0.49) HTR2ABCL9CTNNB1GAAMAPT
SCHEMBL14879240 0.88 HTR2A (0.47) HTR2ABCL9CTNNB1GAAMAPT
SCHEMBL13474589 0.85 HTR2A (0.48) HTR2ABCL9CTNNB1GAAMAPT
SCHEMBL14712301 0.84 HTR2A (0.46) HTR2ABCL9CTNNB1GAAMAPT
SCHEMBL23915970 0.84 HTR2A (0.44) HTR2ABCL9CTNNB1GAAMAPT
SCHEMBL22546645 0.84 HTR2A (0.44) HTR2ABCL9CTNNB1GAAMAPT
SCHEMBL21097079 0.83 HTR2A (0.52) HTR2ABCL9CTNNB1GAAMAPT
SCHEMBL7080623 0.82 HTR2A (0.53) HTR2ABCL9CTNNB1GAAMAPT
SCHEMBL2597400 0.81 BCL9 (0.63) HTR2ABCL9CTNNB1GAAMAPT
SCHEMBL278663 0.81 BCL9 (0.62) HTR2ABCL9CTNNB1GAAMAPT

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-20230114866-A1 VIA CYCLOADDITION BILATERALLY FUNCTIONALIZED ANTIBODIES SYNAFFIX B.V. (NL) 2023-04-13 — — 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-20230114866-A1 VIA CYCLOADDITION BILATERALLY FUNCTIONALIZED ANTIBODIES FUT5, FUCA1, FUT6 HTR2A 3561/4885BCL9 2230/4885CTNNB1 2680/4885

“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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