SCHEMBL18044894

SCHEMBL18044894

Cc1ccc(S(=O)(=O)c2cc(C(N)=O)c(NC(=O)c3ccccc3F)s2)cc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 5/20 0.58
▸ POLB P06746 1/20 0.51
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ CRHBP P24387 1/20 0.46
▸ CRHR2 Q13324 1/20 0.46
▸ ALDH1A1 P00352 3/20 0.45
▸ LMNA P02545 2/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ HPGD P15428 1/20 0.45
▸ NPC1 O15118 4/20 0.45
▸ RAB9A P51151 3/20 0.44
▸ KAT6A Q92794 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ GLA P06280 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ IKBKB O14920 1/20 0.42

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
SCHEMBL16246393 0.91 CFTR (0.66) CFTRMEN1KMT2ACRHBPCRHR2
SCHEMBL16246494 0.91 CFTR (0.56) CFTRMEN1KMT2ACRHBPCRHR2
SCHEMBL19772486 0.86 CFTR (0.56) CFTRMEN1KMT2ACRHBPCRHR2
SCHEMBL16246226 0.85 CFTR (0.53) CFTRCRHBPCRHR2ALDH1A1LMNA
SCHEMBL16337977 0.85 CFTR (0.50) CFTRPOLBMEN1KMT2AALDH1A1
SCHEMBL16387393 0.85 RXFP1 (0.48) CFTRPOLBMEN1KMT2AALDH1A1
SCHEMBL16246560 0.84 CFTR (0.51) CFTRMEN1KMT2ACRHBPCRHR2
SCHEMBL16246356 0.84 NPC1 (0.48) CFTRMEN1KMT2AALDH1A1LMNA
SCHEMBL16246210 0.83 CFTR (0.60) CFTRPOLBMEN1KMT2AALDH1A1
SCHEMBL16246509 0.82 NPC1 (0.47) CFTRMEN1KMT2AALDH1A1LMNA

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-9867806-B2 Compounds and pharmaceutical compositions thereof for the treatment of cystic fibrosis GALAPAGOS NV (BE) 2018-01-16 — — US disclosed
US-20160263084-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF CYSTIC FIBROSIS GALAPAGOS NV (BE) 2016-09-15 — — 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-20160263084-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF CYSTIC FIBROSIS CFTR, ABCC3, ABCC5 CFTR 1/4885POLB 3578/4885MEN1 3603/4885

“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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