SCHEMBL20237993

SCHEMBL20237993

COc1ccc(CNc2cc(C)ncn2)c(OC)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 18/20 0.67
CYP3A4 P08684 18/20 0.67
CYP2D6 P10635 18/20 0.67
CYP2C19 P33261 16/20 0.67
TSHR P16473 15/20 0.67
CLK4 Q9HAZ1 10/20 0.67
LMNA P02545 7/20 0.67
MAPK1 P28482 6/20 0.67
USP2 O75604 8/20 0.67
HSD17B10 Q99714 7/20 0.67
ALDH1A1 P00352 6/20 0.67
ALOX15 P16050 3/20 0.67
MEN1 O00255 5/20 0.63
KMT2A Q03164 5/20 0.63
GLA P06280 1/20 0.63
MAPT P10636 1/20 0.59
CYP2C9 P11712 4/20 0.55
APLNR P35414 1/20 0.55
HPGD P15428 1/20 0.55
HTT P42858 1/20 0.55

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
SCHEMBL20252605 0.88 CYP1A2 (0.56) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL30711679 0.86 CYP1A2 (0.67) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL1690631 0.85 CYP1A2 (0.68) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL16368537 0.82 CYP1A2 (0.62) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL23925667 0.81 CYP1A2 (0.60) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL28975507 0.81 CYP1A2 (0.69) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL30185837 0.81 CYP1A2 (0.69) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL322679 0.81 CYP1A2 (0.61) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL19886457 0.80 CLK4 (0.52) CYP1A2CYP3A4CYP2D6CYP2C19TSHR
SCHEMBL28975506 0.79 CYP1A2 (0.59) CYP1A2CYP3A4CYP2D6CYP2C19TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110325531-B Benzenesulfonamides and their use as therapeutic agents 泽农医药公司 2022-05-27 CN disclosed
US-11174268-B2 Benzenesulfonamide compouds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2021-11-16 US disclosed
US-11174268-B2 Benzenesulfonamide compouds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2021-11-16 US disclosed
US-20210171537-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2021-06-10 US disclosed
US-20210171537-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2021-06-10 US disclosed
EP-3551626-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS Xenon Pharmaceuticals Inc. (CA) 2019-10-16 EP disclosed
CN-110325531-A Benzsulfamide and its purposes as therapeutic agent 泽农医药公司 2019-10-11 CN disclosed
WO-2018106284-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2018-06-14 WO disclosed
US-20180162868-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2018-06-14 US disclosed
US-20180162868-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2018-06-14 US disclosed
WO-2018106284-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2018-06-14 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 (3 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-11174268-B2 Benzenesulfonamide compouds and their use as therapeutic agents KCND2, SCN1A, CACNA1D CYP1A2 831/4885CYP3A4 414/4885CYP2D6 285/4885
US-20210171537-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS SCN1A, SCN1B, SCN2B CYP1A2 926/4885CYP3A4 396/4885CYP2D6 287/4885
US-20180162868-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS SCN1A, SCN1B, SCN2B CYP1A2 926/4885CYP3A4 396/4885CYP2D6 287/4885

“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.