SCHEMBL14934640

SCHEMBL14934640

COc1ccc(CN(c2ncc(F)cn2)S(=O)(=O)c2cc(F)c(F)cc2F)c(OC)c1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.40
GAA P10253 2/20 0.39
ALDH1A1 P00352 3/20 0.37
TSHR P16473 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
RORC P51449 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
KMT2A Q03164 3/20 0.36
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
POLB P06746 1/20 0.36
OXTR P30559 1/20 0.36
APLNR P35414 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL18843922 0.93 MEN1 (0.39) TP53GAAALDH1A1TSHRNPSR1
SCHEMBL321121 0.92 TP53 (0.37) TP53GAAALDH1A1TSHRNPSR1
SCHEMBL14934454 0.91 MAPK1 (0.42) TP53GAAALDH1A1TSHRHDAC8
SCHEMBL16177509 0.88 GAA (0.40) TP53GAAALDH1A1TSHRHDAC8
SCHEMBL320548 0.83 MAPK1 (0.39) TP53GAAALDH1A1TSHRKMT2A
SCHEMBL19613845 0.83 SOS1 (0.40) TP53GAAALDH1A1TSHRNPSR1
SCHEMBL14934460 0.82 ALDH1A1 (0.36) TP53GAAALDH1A1TSHRRORC
SCHEMBL14921462 0.82 CNR1 (0.47) TP53GAAALDH1A1TSHRNPSR1
SCHEMBL14921470 0.81 ALDH1A1 (0.40) ALDH1A1TSHRHDAC8KMT2AKDM4E
SCHEMBL1094098 0.81 KDM4E (0.37) TP53GAAALDH1A1TSHRRORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10316026-B2 Method for removing dimethoxybenzyl group DAIICHI SANKYO COMPANY, LIMITED (JP) 2019-06-11 US disclosed
US-10316026-B2 Method for removing dimethoxybenzyl group DAIICHI SANKYO COMPANY, LIMITED (JP) 2019-06-11 US disclosed
EP-3372583-A1 METHOD FOR REMOVING DIMETHOXYBENZYL GROUP DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-09-12 EP disclosed
US-20180251448-A1 METHOD FOR REMOVING DIMETHOXYBENZYL GROUP DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-09-06 US disclosed
WO-2017078123-A1 METHOD FOR REMOVING DIMETHOXYBENZYL GROUP 第一三共株式会社 2017-05-11 WO disclosed
US-9630929-B2 Benzenesulfonamide compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2017-04-25 US disclosed
US-9630929-B2 Benzenesulfonamide compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2017-04-25 US disclosed
US-9630929-B2 Benzenesulfonamide compounds and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2017-04-25 US disclosed
EP-2773637-B1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2016-06-08 EP disclosed
EP-2773637-B1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2016-06-08 EP disclosed
US-20140296245-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS, INC. (CA) 2014-10-02 US disclosed
US-20140296245-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS, INC. (CA) 2014-10-02 US disclosed
US-20140296245-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS, INC. (CA) 2014-10-02 US disclosed
WO-2013064983-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC. (CA) 2013-05-10 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-20180251448-A1 METHOD FOR REMOVING DIMETHOXYBENZYL GROUP DDT, ALKBH5, DDO TP53 713/4885GAA 2164/4885ALDH1A1 1602/4885
US-20140296245-A1 BENZENESULFONAMIDE COMPOUNDS AND THEIR USE AS THERAPEUTIC AGENTS TRPV1, TRPA1, TRPV3 TP53 1018/4885GAA 1392/4885ALDH1A1 2347/4885
US-10316026-B2 Method for removing dimethoxybenzyl group DDT, ALKBH5, DDO TP53 713/4885GAA 2164/4885ALDH1A1 1602/4885

“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.