SCHEMBL3374882

SCHEMBL3374882

O=S(=O)(Nc1ccc(-c2ccc(Oc3ccccc3)cc2)cc1)C1CC1

nearest known ligand 0.55

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PGR P06401 12/20 0.55
HPGD P15428 1/20 0.51
HTT P42858 1/20 0.51
UCHL1 P09936 1/20 0.50
USP30 Q70CQ3 1/20 0.50
SCN9A Q15858 1/20 0.50
HDAC4 P56524 1/20 0.48
FFAR1 O14842 2/20 0.48
FFAR4 Q5NUL3 1/20 0.48
SGK1 O00141 1/20 0.46

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
SCHEMBL3376000 0.83 PGR (0.46) PGRHPGDHTTSCN9A
SCHEMBL13337362 0.81 SCN9A (0.41) PGRHPGDHTTSCN9AHDAC4
SCHEMBL3378360 0.80 PGR (0.43) PGRHPGDHTTUCHL1USP30
SCHEMBL6850398 0.80 HDAC4 (0.56) PGRUCHL1USP30HDAC4SGK1
SCHEMBL3377038 0.78 ACLY (0.60) SCN9A
SCHEMBL3375581 0.78 HDAC4 (0.41) PGRSCN9AHDAC4
SCHEMBL3376915 0.78 PGR (0.90) PGRHPGDHTTFFAR1FFAR4
SCHEMBL3375824 0.77 ACLY (0.45) PGRHPGDUCHL1USP30SCN9A
SCHEMBL3375684 0.75 ACLY (0.43) PGRSCN9A
SCHEMBL3378469 0.75 ACLY (0.51) SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389500-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2013-03-05 US claimed
WO-2010056527-A2 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-20 WO claimed
US-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-06 US claimed
US-8389500-B2 Fused heterocyclic compounds as ion channel modulators GILEAD SCIENCES, INC. (US) 2013-03-05 US disclosed
WO-2010056527-A2 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-20 WO disclosed
US-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS GILEAD PALO ALTO, INC. (US) 2010-05-06 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-20100113449-A1 FUSED HETEROCYCLIC COMPOUNDS AS ION CHANNEL MODULATORS KCNJ2, HCN4, KCNH2 PGR 4327/4885HPGD 633/4885HTT 444/4885

“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.