SCHEMBL17835876

SCHEMBL17835876

CN(C)CC(Oc1ccc(C(=O)O)cc1F)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
MAPK1 P28482 2/20 0.50
HTT P42858 2/20 0.50
RAB9A P51151 1/20 0.50
NOX1 Q9Y5S8 4/20 0.48
SLC6A4 P31645 3/20 0.44
ACHE P22303 1/20 0.43
PPARG P37231 1/20 0.42
PPARA Q07869 1/20 0.42
MRGPRX4 Q96LA9 2/20 0.40
TTR P02766 1/20 0.40
THRA P10827 1/20 0.40
THRB P10828 1/20 0.40
TP53 P04637 1/20 0.39
MAPT P10636 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL17835875 1.00 LMNA (0.50) LMNAMAPK1HTTRAB9ANOX1
SCHEMBL17835849 0.89 NOX1 (0.50) LMNAMAPK1HTTRAB9ANOX1
SCHEMBL17835850 0.89 NOX1 (0.50) LMNAMAPK1HTTRAB9ANOX1
SCHEMBL17835596 0.85 TTR (0.56) HTTNOX1ACHETTR
SCHEMBL17835593 0.85 TTR (0.56) HTTNOX1ACHETTR
SCHEMBL17835644 0.76 NOX1 (0.56) RAB9ANOX1TTRMAPT
SCHEMBL17835645 0.76 NOX1 (0.56) RAB9ANOX1TTRMAPT
SCHEMBL17835856 0.76 NOX1 (0.74) NOX1
SCHEMBL17835667 0.76 NOX1 (0.74) NOX1
SCHEMBL17835562 0.74 SLC6A4 (0.46) LMNAMAPK1HTTRAB9ANOX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190046515-A1 AMIDO THIADIAZOLE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYOTEX SA (CH) 2019-02-14 US disclosed
US-10130619-B2 Amido thiadiazole derivatives as NADPH oxidase inhibitors GENKYOTEX SUISSE SA (CH) 2018-11-20 US disclosed
US-20170348296-A1 AMIDO THIADIAZOLE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYOTEX SUISSE SA (CH) 2017-12-07 US disclosed
EP-3034500-A1 Amido thiazole derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2016-06-22 EP 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 (3 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-20170348296-A1 AMIDO THIADIAZOLE DERIVATIVES AS NADPH OXIDASE INHIBITORS NOX1, NOX5, CYBB LMNA 4266/4885MAPK1 839/4885HTT 3648/4885
US-20190046515-A1 AMIDO THIADIAZOLE DERIVATIVES AS NADPH OXIDASE INHIBITORS NOX1, NOX5, CYBB LMNA 4266/4885MAPK1 839/4885HTT 3648/4885
US-10130619-B2 Amido thiadiazole derivatives as NADPH oxidase inhibitors NOX1, NOX5, CYBB LMNA 4266/4885MAPK1 839/4885HTT 3648/4885

“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.