SCHEMBL23656643

SCHEMBL23656643

CCOC(=O)Cc1ccccc1O/C(=C/C(B1OC(C)(C)C(C)(C)O1)=C(\C)O)C(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TBXAS1 P24557 1/20 0.34
▸ AKR1C3 P42330 1/20 0.33
▸ AKR1C2 P52895 1/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ PKM P14618 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ HPGD P15428 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ FFAR1 O14842 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GAA P10253 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ PPID Q08752 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
SCHEMBL25895072 0.89 TBXAS1 (0.37) TBXAS1AKR1C3AKR1C2L3MBTL1PKM
SCHEMBL21455148 0.89 TBXAS1 (0.37) TBXAS1AKR1C3AKR1C2L3MBTL1PKM
SCHEMBL23656672 0.88 TBXAS1 (0.36) TBXAS1AKR1C3AKR1C2L3MBTL1PKM
SCHEMBL21455145 0.86 TBXAS1 (0.36) TBXAS1AKR1C3AKR1C2L3MBTL1PKM
SCHEMBL25894394 0.86 TBXAS1 (0.36) TBXAS1AKR1C3AKR1C2L3MBTL1PKM
SCHEMBL24200110 0.84 TBXAS1 (0.33) TBXAS1PKM
SCHEMBL21455441 0.83 TBXAS1 (0.36) TBXAS1AKR1C3AKR1C2L3MBTL1PKM
SCHEMBL21455527 0.80 TBXAS1 (0.35) TBXAS1AKR1C3AKR1C2L3MBTL1PKM
SCHEMBL24200111 0.80 TBXAS1 (0.39) TBXAS1L3MBTL1PKMHPGDMEN1
SCHEMBL25097868 0.80 TBXAS1 (0.36) TBXAS1AKR1C3AKR1C2L3MBTL1PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230072867-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-03-09 — — US disclosed
US-11370774-B2 Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2022-06-28 — — US disclosed
US-20210221786-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2021-07-22 — — 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 (3 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-20230072867-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS C9, C5, C1QBP TBXAS1 75/4885AKR1C3 180/4885AKR1C2 1442/4885
US-11370774-B2 Substituted benzofuran, benzopyrrole, benzothiophene, and structurally related complement inhibitors C9, C5, C1QBP TBXAS1 75/4885AKR1C3 180/4885AKR1C2 1442/4885
US-20210221786-A1 SUBSTITUTED BENZOFURAN, BENZOPYRROLE, BENZOTHIOPHENE, AND STRUCTURALLY RELATED COMPLEMENT INHIBITORS C9, C5, C1QBP TBXAS1 75/4885AKR1C3 180/4885AKR1C2 1442/4885

“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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