SCHEMBL29601273

SCHEMBL29601273

O=C(Nc1ccc(F)cc1)c1c(NC(=O)C(F)(F)F)sc2c1CCOC2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ANO1 Q5XXA6 16/20 1.00
ANO2 Q9NQ90 2/20 0.60
CXCR2 P25025 1/20 0.59
TP53 P04637 3/20 0.59
MAPT P10636 3/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
BLM P54132 1/20 0.52

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
SCHEMBL4132103 0.92 ANO1 (0.84) ANO1ANO2TP53MAPTSMN1; SMN2
SCHEMBL20541616 0.91 ANO1 (1.00) ANO1ANO2TP53MAPTSMN1; SMN2
SCHEMBL4134944 0.88 ANO1 (0.80) ANO1ANO2CXCR2TP53MAPT
SCHEMBL29601564 0.84 ANO1 (1.00) ANO1ANO2TP53MAPTSMN1; SMN2
SCHEMBL4149988 0.84 MAPT (0.75) ANO1ANO2TP53MAPTSMN1; SMN2
SCHEMBL29601265 0.84 ANO1 (1.00) ANO1ANO2TP53MAPTSMN1; SMN2
SCHEMBL4139722 0.83 ANO1 (0.71) ANO1ANO2TP53MAPTSMN1; SMN2
SCHEMBL4141589 0.81 PTPRC (0.70) ANO1ANO2CXCR2
SCHEMBL29601567 0.81 ANO1 (1.00) ANO1ANO2TP53MAPTSMN1; SMN2
SCHEMBL5457888 0.78 ANO1 (0.64) ANO1CXCR2MAPT

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-11358947-B2 Substituted 2-acylamino-cycloalkylthiophene-3-carboxylic acid arylamides as inhibitors of calcium-activated chloride channel TMEM16A THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2022-06-14 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-11358947-B2 Substituted 2-acylamino-cycloalkylthiophene-3-carboxylic acid arylamides as inhibitors of calcium-activated chloride channel TMEM16A TMEM161A, ANO2, TRPV6 ANO1 9/4885ANO2 2/4885CXCR2 1986/4885

“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.