SCHEMBL26978804

SCHEMBL26978804

CC(C)(C)COc1cccc(B2OC(C)(C)C(C)(C)O2)c1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ LIPG Q9Y5X9 8/20 0.46
▸ LPL P06858 7/20 0.46
▸ AAK1 Q2M2I8 3/20 0.39
▸ HIF1A Q16665 3/20 0.38
▸ DGAT1 O75907 2/20 0.38
▸ PDK2 Q15119 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ F11 P03951 1/20 0.35

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
SCHEMBL29656921 0.89 LIPG (0.44) LIPGLPLAAK1HIF1ADGAT1
SCHEMBL29103279 0.89 LIPG (0.44) LIPGLPLAAK1HIF1ADGAT1
SCHEMBL22290583 0.89 LIPG (0.44) LIPGLPLAAK1HIF1ADGAT1
SCHEMBL19384526 0.87 LIPG (0.43) LIPGLPLAAK1HIF1ADGAT1
SCHEMBL31627012 0.87 LPL (0.45) LIPGLPLAAK1HIF1ADGAT1
SCHEMBL2450679 0.87 LPL (0.45) LIPGLPLAAK1HIF1ADGAT1
SCHEMBL23363514 0.86 LIPG (0.42) LIPGLPLAAK1HIF1ADGAT1
SCHEMBL29899260 0.86 LPL (0.42) LIPGLPLAAK1HIF1ADGAT1
SCHEMBL23363581 0.86 LPL (0.42) LIPGLPLAAK1HIF1ADGAT1
SCHEMBL31626924 0.86 LIPG (0.44) LIPGLPLAAK1HIF1ADGAT1

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-20240002374-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY GENZYME CORPORATION 2024-01-04 — — US disclosed
CN-115003659-A 5-membered heteroaryl amino sulfonamides for the treatment of conditions mediated by a deficiency in CFTR activity 健赞公司 2022-09-02 — — CN 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-20240002374-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY CFTR, PKD2, PKD1 LIPG 2840/4885LPL 1522/4885AAK1 4135/4885

“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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