SCHEMBL8388562

SCHEMBL8388562

Cc1ccc(S(=O)(=O)Nc2nccs2)cc1

nearest known ligand 0.76

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PPIA P62937 1/20 0.76
ALDH1A1 P00352 6/20 0.72
LMNA P02545 2/20 0.72
TDP1 Q9NUW8 2/20 0.72
KDM4E B2RXH2 1/20 0.72
CYP2C9 P11712 1/20 0.72
EDNRA P25101 1/20 0.72
SLC6A4 P31645 1/20 0.72
ADRA1A P35348 1/20 0.72
PRMT6 Q96LA8 1/20 0.72
SMN1; SMN2 Q16637 1/20 0.72
PKM P14618 6/20 0.68
MEN1 O00255 6/20 0.66
KMT2A Q03164 6/20 0.66
CYP1A2 P05177 1/20 0.65
POLB P06746 2/20 0.62
ATM Q13315 1/20 0.60
MAPT P10636 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60

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
SCHEMBL16273104 0.86 SCN3A (0.74) PPIAALDH1A1LMNATDP1KDM4E
SCHEMBL3066836 0.85 LMNA (0.79) PPIAALDH1A1LMNATDP1KDM4E
SCHEMBL13212127 0.85 PTPN1 (0.80) PPIAALDH1A1LMNATDP1KDM4E
SCHEMBL13452528 0.84 MEN1 (0.71) PPIAALDH1A1LMNATDP1KDM4E
SCHEMBL13180843 0.84 ALDH1A1 (0.72) PPIAALDH1A1LMNATDP1KDM4E
Sulfathiazole SCHEMBL30130508 0.84 ALDH1A1 (1.00) PPIAALDH1A1LMNATDP1KDM4E
SCHEMBL184078 0.84 ALDH1A1 (0.72) PPIAALDH1A1LMNATDP1KDM4E
SCHEMBL183995 0.84 ALDH1A1 (0.72) PPIAALDH1A1LMNATDP1KDM4E
Sulfathiazole SCHEMBL94165 0.84 ALDH1A1 (1.00) PPIAALDH1A1LMNATDP1KDM4E
SCHEMBL1650814 0.84 ALDH1A1 (0.72) PPIAALDH1A1LMNATDP1KDM4E

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 12 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-8124610-B2 Sodium channel inhibitors ICAGEN INC. (US) 2012-02-28 US disclosed
US-7615563-B2 Compositions useful as inhibitors of voltage-gated sodium channels VERTEX PHARMACEUTICALS INCORPORATED 2009-11-10 US disclosed
US-20090023740-A1 SODIUM CHANNEL INHIBITORS ICAGEN (US) 2009-01-22 US disclosed
US-20080227785-A1 2,4,6-TRIAMINO-1,3,5-TRIAZINE DERIVATIVE ASTELLAS PHARMA INC. (JP) 2008-09-18 US disclosed
US-7375222-B2 2,4,6-Triamino-1,3,5-triazine derivative ASTELLAS PHARMA INC. (JP) 2008-05-20 US disclosed
US-7375222-B2 2,4,6-Triamino-1,3,5-triazine derivative ASTELLAS PHARMA INC. (JP) 2008-05-20 US disclosed
US-20060025415-A1 Compositions useful as inhibitors of voltage-gated sodium channels VERTEX PHARMACEUTICALS INCORPORATED 2006-02-02 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 (5 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 PPIA 4564/4885ALDH1A1 1602/4885LMNA 1411/4885
US-20090023740-A1 SODIUM CHANNEL INHIBITORS TRPV1, SCN1A, SCN2A PPIA 1667/4885ALDH1A1 3333/4885LMNA 2921/4885
US-20060025415-A1 Compositions useful as inhibitors of voltage-gated sodium channels SCNN1G, KCNN3, KCNN2 PPIA 2483/4885ALDH1A1 2811/4885LMNA 1374/4885
US-20080227785-A1 2,4,6-TRIAMINO-1,3,5-TRIAZINE DERIVATIVE KCNT1, KCNMA1, KCNJ2 PPIA 4870/4885ALDH1A1 2383/4885LMNA 3239/4885
US-10316026-B2 Method for removing dimethoxybenzyl group DDT, ALKBH5, DDO PPIA 4564/4885ALDH1A1 1602/4885LMNA 1411/4885

“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.