SCHEMBL22230136

SCHEMBL22230136

CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2c-1nc1cc3c(cc1c2CCc1ccc(Br)cc1)OCO3

nearest known ligand 0.78

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TOP1 P11387 19/20 0.78
▸ SLC2A1 P11166 1/20 0.64

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
SCHEMBL22230104 0.93 TOP1 (0.80) TOP1SLC2A1
SCHEMBL22230084 0.93 TOP1 (0.87) TOP1
SCHEMBL22230172 0.91 TOP1 (0.75) TOP1SLC2A1
SCHEMBL23255589 0.90 TOP1 (0.73) TOP1SLC2A1
SCHEMBL21592225 0.89 TOP1 (0.72) TOP1SLC2A1
SCHEMBL23255710 0.89 TOP1 (0.72) TOP1SLC2A1
SCHEMBL21591948 0.89 TOP1 (0.72) TOP1SLC2A1
SCHEMBL21564110 0.89 TOP1 (0.87) TOP1SLC2A1
SCHEMBL22230099 0.89 TOP1 (0.73) TOP1SLC2A1
SCHEMBL24642747 0.89 TOP1 (0.86) TOP1SLC2A1

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
CN-112770755-A Compositions, syntheses, preparations and uses of analogs derived from position 7 and 9 of platform drug FL118 for treating human diseases 坎格特生物技术制药有限责任公司 2021-05-07 — — CN disclosed
US-20200231596-A1 MATTER OF COMPOSITION, SYNTHESIS, FORMULATION AND APPLICATION OF FL118 PLATFORM POSITIONS 7 AND 9-DERIVED ANALOGUES FOR TREATMENT OF HUMAN DISEASE CANGET BIOTEKPHARMA 2020-07-23 — — 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-20200231596-A1 MATTER OF COMPOSITION, SYNTHESIS, FORMULATION AND APPLICATION OF FL118 PLATFORM POSITIONS 7 AND 9-DERIVED ANALOGUES FOR TREATMENT OF HUMAN DISEASE TP53, BRCA1, MET TOP1 2368/4885SLC2A1 4162/4885

“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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