SCHEMBL22776384

SCHEMBL22776384

CC(C)(C)OC(=O)N1C[C@@H](OCc2ccccc2)C[C@]1(C=O)Cc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 2/20 0.39
KLK7 P49862 1/20 0.38
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
CHRM3 P20309 1/20 0.36
JAK2 O60674 1/20 0.36
JAK1 P23458 1/20 0.36
BCHE P06276 2/20 0.36
STS P08842 1/20 0.35
CTSL P07711 1/20 0.35
CTSB P07858 1/20 0.35
CTSK P43235 1/20 0.35
GRIN2B Q13224 1/20 0.35
YAP1 P46937 1/20 0.35
BACE1 P56817 1/20 0.34
BACE2 Q9Y5Z0 1/20 0.34
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34

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
SCHEMBL22777559 0.89 KLK7 (0.38) ABCB1KLK7PDE4APDE4BPDE4C
SCHEMBL22776875 0.82 ABCB1 (0.39) ABCB1KLK7PDE4APDE4BPDE4C
SCHEMBL22776873 0.82 ABCB1 (0.39) ABCB1KLK7PDE4APDE4BPDE4C
SCHEMBL24622152 0.81 ABCB1 (0.41) ABCB1KLK7CHRM3JAK2JAK1
SCHEMBL21996508 0.81 ABCB1 (0.41) ABCB1KLK7CHRM3JAK2JAK1
SCHEMBL22047128 0.81 ABCB1 (0.41) ABCB1KLK7CHRM3JAK2JAK1
SCHEMBL5151803 0.81 ABCB1 (0.41) ABCB1KLK7CHRM3JAK2JAK1
SCHEMBL21996534 0.81 ABCB1 (0.41) ABCB1KLK7CHRM3JAK2JAK1
SCHEMBL704571 0.81 ABCB1 (0.41) ABCB1KLK7CHRM3JAK2JAK1
SCHEMBL23043429 0.81 ABCB1 (0.41) ABCB1KLK7CHRM3JAK2JAK1

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-3983414-B1 HYDROXYPYRROLIDINE-SUBSTITUTED ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS MERCK SHARP & DOHME LLC (US) 2026-04-01 EP disclosed
US-12427159-B2 Hydroxypyrrolidine-substituted arylsulfonamide compounds with selective activity in voltage-gated sodium channels MERCK SHARP & DOHME LLC (US) 2025-09-30 US disclosed
US-20220305035-A1 HYDROXYPYRROLIDINE-SUBSTITUTED ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS MERCK SHARP & DOHME CORP. (US) 2022-09-29 US disclosed
EP-3983414-A1 HYDROXYPYRROLIDINE-SUBSTITUTED ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS Merck Sharp & Dohme Corp. (US) 2022-04-20 EP disclosed
WO-2020251872-A1 HYDROXYPYRROLIDINE-SUBSTITUTED ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS MERCK SHARP & DOHME CORP. (US) 2020-12-17 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 (2 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-12427159-B2 Hydroxypyrrolidine-substituted arylsulfonamide compounds with selective activity in voltage-gated sodium channels TRPV1, SCN1A, SCN7A ABCB1 845/4885KLK7 1656/4885PDE4A 1194/4885
US-20220305035-A1 HYDROXYPYRROLIDINE-SUBSTITUTED ARYLSULFONAMIDE COMPOUNDS WITH SELECTIVE ACTIVITY IN VOLTAGE-GATED SODIUM CHANNELS TRPV1, SCN1A, SCN7A ABCB1 845/4885KLK7 1656/4885PDE4A 1194/4885

“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.