SCHEMBL26980490

SCHEMBL26980490

CC1(C)OB(c2cccc(C3(OC(F)(F)F)CCCC3)c2)OC1(C)C

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.39
LIPG Q9Y5X9 7/20 0.39
ROCK1 Q13464 1/20 0.31
F2 P00734 1/20 0.31
F11 P03951 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
EGFR P00533 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 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
SCHEMBL24174506 0.77 LIPG (0.43) LPLLIPGROCK1F2F11
SCHEMBL22290338 0.75 LIPG (0.43) LPLLIPGROCK1EGFRIRAK4
SCHEMBL30404611 0.75 LIPG (0.46) LPLLIPGROCK1EGFRIRAK4
SCHEMBL24175626 0.75 LIPG (0.46) LPLLIPGROCK1EGFRIRAK4
SCHEMBL29933385 0.72 LIPG (0.46) LPLLIPGROCK1F11IRAK4
SCHEMBL28843389 0.72 LIPG (0.46) LPLLIPGROCK1F11IRAK4
SCHEMBL5892571 0.71 LPL (0.44) LPLLIPGF2F11PRSS1
SCHEMBL29777947 0.71 LPL (0.44) LPLLIPGF2F11PRSS1
SCHEMBL1476213 0.70 LIPG (0.59) LPLLIPGF11EGFRIRAK4
SCHEMBL25351139 0.69 LMNA (0.48) LPLLIPGROCK1F2F11

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-20240002374-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY GENZYME CORPORATION 2024-01-04 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-20240002374-A1 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY CFTR, PKD2, PKD1 LPL 1522/4885LIPG 2840/4885ROCK1 4600/4885

“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.