SCHEMBL5383096

SCHEMBL5383096

O=C(Nc1ccc(F)c(C(F)(F)F)c1)C1C(=O)C2CCC(C2)C1=O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 1/20 0.46
▸ GRM4 Q14833 1/20 0.45
▸ KDR P35968 11/20 0.44
▸ BRAF P15056 5/20 0.44
▸ NPY5R Q15761 1/20 0.42
▸ KCNQ3 O43525 1/20 0.40
▸ KCNQ2 O43526 1/20 0.40
▸ KCNE1 P15382 1/20 0.40
▸ KCNQ1 P51787 1/20 0.40
▸ UBE2M P61081 1/20 0.40
▸ DCUN1D1 Q96GG9 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
SCHEMBL5388908 0.86 KDR (0.57) GRM4KDR
SCHEMBL5375015 0.82 AR (0.46) ARGRM4KDRBRAFNPY5R
SCHEMBL5376240 0.80 EPHX2 (0.50) —
SCHEMBL5374656 0.79 SMN1; SMN2 (0.56) UBE2MDCUN1D1
SCHEMBL9892929 0.78 AR (0.49) ARGRM4KDRBRAFNPY5R
SCHEMBL5371798 0.78 MAPT (0.45) —
SCHEMBL24515714 0.77 AR (0.51) ARGRM4KDRBRAFUBE2M
SCHEMBL26613003 0.77 AR (0.48) ARGRM4KDRBRAFNPY5R
Bromide SCHEMBL30638609 0.76 AR (0.47) ARGRM4KDRBRAFNPY5R
SCHEMBL5380110 0.75 AR (0.42) ARGRM4KDRBRAFNPY5R

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-7179943-B2 Bicyclic derivatives that modulate voltage-gated potassium channels and methods of use thereof WYETH (US) 2007-02-20 — — US claimed
US-20060004108-A1 Bicyclic derivatives that modulate voltage-gated potassium channels and methods of use thereof WYETH (US) 2006-01-05 — — US claimed
US-7179943-B2 Bicyclic derivatives that modulate voltage-gated potassium channels and methods of use thereof WYETH (US) 2007-02-20 — — US disclosed
US-20060004108-A1 Bicyclic derivatives that modulate voltage-gated potassium channels and methods of use thereof WYETH (US) 2006-01-05 — — 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-20060004108-A1 Bicyclic derivatives that modulate voltage-gated potassium channels and methods of use thereof KCNAB1, KCNA1, KCNN1 AR 3664/4885GRM4 296/4885KDR 1571/4885

“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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