SCHEMBL6983167

SCHEMBL6983167

FC(F)(F)c1ccccc1-c1sc2ccccc2c1-c1cccnc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPY5R Q15761 1/20 0.52
▸ USP1 O94782 2/20 0.43
▸ WDR48 Q8TAF3 2/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ CYP11B1 P15538 2/20 0.41
▸ CYP11B2 P19099 1/20 0.41
▸ SCN9A Q15858 2/20 0.40
▸ PDK2 Q15119 1/20 0.40
▸ CYP1A2 P05177 4/20 0.39
▸ CYP3A4 P08684 4/20 0.39
▸ CYP2D6 P10635 4/20 0.39
▸ CYP2C19 P33261 4/20 0.39
▸ USP2 O75604 2/20 0.39
▸ ALOX15 P16050 1/20 0.39
▸ CASP1 P29466 1/20 0.39
▸ CASP7 P55210 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ HSP90AA1 P07900 1/20 0.38
▸ SCN5A Q14524 1/20 0.38

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
Hydrochloric Acid SCHEMBL6987909 0.99 NPY5R (0.51) NPY5RUSP1WDR48L3MBTL1CYP11B1
SCHEMBL12692422 0.77 NPY5R (0.64) NPY5RUSP1WDR48CYP11B1CYP11B2
SCHEMBL29295367 0.73 USP1 (0.49) NPY5RUSP1WDR48CYP11B1CYP11B2
SCHEMBL29293345 0.72 NPY5R (0.46) NPY5RUSP1WDR48CYP11B1CYP11B2
SCHEMBL13057724 0.69 NPY5R (0.49) NPY5RUSP1WDR48CYP11B1CYP11B2
SCHEMBL6983163 0.69 NPY5R (0.46) NPY5RUSP1WDR48CYP11B1CYP11B2
SCHEMBL5793081 0.69 CYP11B2 (0.44) CYP11B1CYP11B2CYP1A2CYP3A4NPC1
SCHEMBL13057058 0.69 NPY5R (0.54) NPY5RUSP1WDR48CYP11B1CYP11B2
Hydrochloric Acid SCHEMBL6987907 0.68 NPY5R (0.46) NPY5RUSP1WDR48CYP11B1CYP11B2
SCHEMBL13056285 0.68 NPY5R (0.48) NPY5RUSP1WDR48CYP11B1CYP11B2

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-20030130340-A1 Novel benzothiophene derivatives DAIICHI PHARMACEUTICAL CO. LTD. 2003-07-10 — — US disclosed
EP-1283209-A1 NOVEL BENZOTHIOPHENE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-02-12 — — 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 (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-20030130340-A1 Novel benzothiophene derivatives CYP17A1, CYP21A2, HSD17B1 NPY5R 1329/4885USP1 1613/4885WDR48 2986/4885

“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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