SCHEMBL1428388

SCHEMBL1428388

COC(=O)CC(c1ccccc1)c1ccc(OC)c(S(=O)(=O)Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.45
▸ MAPK1 P28482 2/20 0.45
▸ PDE4D Q08499 4/20 0.44
▸ TNF P01375 4/20 0.44
▸ PDE4A P27815 3/20 0.44
▸ PDE4B Q07343 3/20 0.44
▸ PDE4C Q08493 3/20 0.44
▸ MAPT P10636 3/20 0.42
▸ HPGD P15428 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ TACR1 P25103 1/20 0.40
▸ KCNA5 P22460 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ LMNA P02545 1/20 0.40

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
SCHEMBL1428480 0.89 ALDH1A1 (0.46) ALDH1A1MAPK1PDE4DTNFPDE4A
SCHEMBL1429007 0.83 PDE4D (0.43) ALDH1A1MAPK1PDE4DTNFPDE4A
SCHEMBL4825769 0.78 PDE4D (0.64) PDE4DTNFPDE4APDE4BPDE4C
SCHEMBL2347309 0.77 HPGD (0.57) ALDH1A1MAPTHPGDKMT2ATACR1
SCHEMBL9444890 0.75 SLC6A3 (0.48) ALDH1A1HPGDSMN1; SMN2CYP3A4LMNA
SCHEMBL20057557 0.74 TRPV4 (0.47) ALDH1A1HPGDSMN1; SMN2NPSR1TSHR
SCHEMBL1429119 0.74 KMT2A (0.60) ALDH1A1HPGDNPSR1MEN1KMT2A
SCHEMBL14278017 0.74 PDE4A (0.37) ALDH1A1MAPK1PDE4DTNFPDE4A
SCHEMBL9228927 0.73 LMNA (0.55) ALDH1A1MAPK1MAPTHPGDSMN1; SMN2
SCHEMBL2890299 0.73 TNF (0.47) ALDH1A1PDE4DTNFPDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2300010-B1 PYRAZINE DERIVATIVES AS EPITHELIAL SODIUM CHANNEL BLOCKERS NOVARTIS AG (CH) 2015-03-04 — — EP disclosed
US-8236808-B2 Pyrazine derivatives as ENAC blockers NOVARTIS AG (CH) 2012-08-07 — — US disclosed
US-20110201625-A1 Organic Comopunds NOVARTIS AG (CH) 2011-08-18 — — US disclosed
EP-2300010-A2 ORGANIC COMPOUNDS Novartis AG (CH) 2011-03-30 — — EP disclosed
WO-2009150137-A2 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2009-12-17 — — WO 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-20110201625-A1 Organic Comopunds OR10J3, CFTR, CLIC1 ALDH1A1 2244/4885MAPK1 3731/4885PDE4D 2904/4885

“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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