SCHEMBL30583774

SCHEMBL30583774

CCOC(=O)[C@H](C)NP(=O)(Oc1ccc(Cl)cc1)Oc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.48
▸ GAA P10253 2/20 0.48
▸ CA1 P00915 2/20 0.47
▸ CA2 P00918 2/20 0.47
▸ BCHE P06276 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ MAPT P10636 5/20 0.46
▸ CRHBP P24387 1/20 0.46
▸ CRHR2 Q13324 1/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ CYP3A4 P08684 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ CES2 O00748 1/20 0.43
▸ CES1 P23141 1/20 0.43
▸ PTPN11 Q06124 1/20 0.43
▸ MEN1 O00255 1/20 0.43

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
SCHEMBL10149592 0.91 BTN3A1 (0.50) ALDH1A1GAACA1CA2BCHE
SCHEMBL28854863 0.91 BTN3A1 (0.50) ALDH1A1GAACA1CA2BCHE
SCHEMBL30089933 0.91 BTN3A1 (0.50) ALDH1A1GAACA1CA2BCHE
SCHEMBL30583776 0.90 CA1 (0.46) ALDH1A1GAACA1CA2BCHE
SCHEMBL30511485 0.89 CA1 (0.47) ALDH1A1GAACA1CA2BCHE
SCHEMBL16258592 0.88 MGLL (0.44) ALDH1A1GAACA1CA2BCHE
SCHEMBL16258593 0.88 MGLL (0.44) ALDH1A1GAACA1CA2BCHE
SCHEMBL30770558 0.88 CA1 (0.44) ALDH1A1GAACA1CA2BCHE
SCHEMBL26277372 0.87 MAPT (0.46) ALDH1A1GAACA1CA2BCHE
SCHEMBL23358327 0.86 CA1 (0.47) ALDH1A1GAACA1CA2BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12202850-B2 Cyclobutyl purine derivative or salt thereof FUJIFILM CORPORATION (JP) 2025-01-21 — — US disclosed
US-20230295202-A1 CYCLOBUTYL PURINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2023-09-21 — — 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 (2 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-20230295202-A1 CYCLOBUTYL PURINE DERIVATIVE OR SALT THEREOF SLC28A1, SLC20A1, SLC29A1 ALDH1A1 504/4885GAA 2977/4885CA1 1860/4885
US-12202850-B2 Cyclobutyl purine derivative or salt thereof SLC28A1, SLC20A1, SLC29A1 ALDH1A1 504/4885GAA 2977/4885CA1 1860/4885

“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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