SCHEMBL19613995

SCHEMBL19613995

O=C(O)NC1CN(Cc2ccccc2)CC12CC2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD4 P21917 4/20 0.44
▸ SIGMAR1 Q99720 1/20 0.44
▸ S1PR1 P21453 1/20 0.43
▸ S1PR5 Q9H228 1/20 0.43
▸ KMT2A Q03164 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ CHRM2 P08172 1/20 0.43
▸ CHRM3 P20309 1/20 0.43
▸ SCN1A P35498 1/20 0.42
▸ SCN8A Q9UQD0 1/20 0.42
▸ FUCA1 P04066 2/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ DRD2 P14416 2/20 0.41
▸ DRD3 P35462 1/20 0.41
▸ ARG1 P05089 1/20 0.41

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
SCHEMBL19613994 1.00 DRD4 (0.44) DRD4SIGMAR1S1PR1S1PR5KMT2A
SCHEMBL12492527 0.95 DRD4 (0.42) DRD4SIGMAR1S1PR1S1PR5KMT2A
SCHEMBL14690752 0.88 DRD4 (0.41) DRD4SIGMAR1S1PR1S1PR5KMT2A
SCHEMBL31598442 0.86 NPY2R (0.42) DRD4SIGMAR1S1PR1S1PR5KMT2A
SCHEMBL8775660 0.83 KMT2A (0.51) SIGMAR1KMT2AALDH1A1MEN1SCN1A
SCHEMBL9245843 0.83 KMT2A (0.51) SIGMAR1KMT2AALDH1A1MEN1SCN1A
SCHEMBL19614040 0.81 JAK2 (0.45) SIGMAR1KMT2AMEN1SCN1ASCN8A
SCHEMBL19133453 0.81 JAK2 (0.45) SIGMAR1KMT2AMEN1SCN1ASCN8A
SCHEMBL19133451 0.81 JAK2 (0.45) SIGMAR1KMT2AMEN1SCN1ASCN8A
SCHEMBL4509125 0.80 ALDH1A1 (0.53) S1PR1S1PR5KMT2AALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200354354-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2020-11-12 — — US disclosed
US-10815229-B1 Benzenesulfonamide compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2020-10-27 — — US disclosed
US-10662184-B2 Benzenesulfonamide compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2020-05-26 — — US disclosed
US-20190194184-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2019-06-27 — — US disclosed
US-10246453-B2 Benzenesulfonamide compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2019-04-02 — — US disclosed
EP-3458449-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS Xenon Pharmaceuticals Inc. (CA) 2019-03-27 — — EP disclosed
US-20170334902-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2017-11-23 — — US disclosed
WO-2017201468-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2017-11-23 — — 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 (6 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-10815229-B1 Benzenesulfonamide compounds and their use as therapeutic agents SCN1A, SCN1B, SCN2B DRD4 3150/4885SIGMAR1 3293/4885S1PR1 1203/4885
US-10246453-B2 Benzenesulfonamide compounds and their use as therapeutic agents SCN1A, SCN1B, SCN2B DRD4 3150/4885SIGMAR1 3293/4885S1PR1 1203/4885
US-20170334902-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS SCN1A, SCN1B, SCN2B DRD4 3150/4885SIGMAR1 3293/4885S1PR1 1203/4885
US-10662184-B2 Benzenesulfonamide compounds and their use as therapeutic agents SCN1A, SCN1B, SCN2B DRD4 3181/4885SIGMAR1 3544/4885S1PR1 1504/4885
US-20200354354-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS SCN1A, SCN1B, SCN2B DRD4 3150/4885SIGMAR1 3293/4885S1PR1 1203/4885
US-20190194184-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS SCN1A, SCN1B, SCN2B DRD4 3181/4885SIGMAR1 3544/4885S1PR1 1504/4885

“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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