SCHEMBL1503802

SCHEMBL1503802

CS(=O)(=O)OC1C[C@H](OS(C)(=O)=O)CN1Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
CHRM2 P08172 2/20 0.37
CHRM4 P08173 2/20 0.37
CHRM5 P08912 2/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
RECQL P46063 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
SLC6A4 P31645 1/20 0.35

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
SCHEMBL5745904 0.87 NR1H2 (0.43) MAPTNR1H2NR1H3SIGMAR1RECQL
SCHEMBL16025064 0.86 MAPT (0.54) MAPTNR1H2NR1H3
SCHEMBL22399609 0.84 GRM6 (0.43) MAPTNR1H2NR1H3CHRM2CHRM4
SCHEMBL22399617 0.84 GRM6 (0.43) MAPTNR1H2NR1H3CHRM2CHRM4
SCHEMBL5369260 0.81 CHRM2 (0.41) MAPTNR1H2NR1H3CHRM2CHRM4
SCHEMBL31127193 0.81 MMP2 (0.46) MAPT
SCHEMBL5746137 0.78 FUCA1 (0.47) SIGMAR1RECQLSMN1; SMN2HRH3
SCHEMBL20799630 0.76 RECQL (0.45) RECQLSMN1; SMN2
SCHEMBL30339801 0.75 OPRD1 (0.44) RECQLSMN1; SMN2
SCHEMBL5744290 0.74 SLC6A4 (0.46) MAPTNR1H2NR1H3SIGMAR1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1405852-B9 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2013-03-27 EP disclosed
EP-1405852-B1 DIAMINE DERIVATIVES DAIICHI SANKYO CO LTD (JP) 2012-08-01 EP disclosed
US-20110312990-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-12-22 US disclosed
EP-2343290-A1 Diamine derivatives as factor X inhibitors Daiichi Sankyo Company, Limited (JP) 2011-07-13 EP disclosed
US-20110077266-A1 Diamine Derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-03-31 US disclosed
US-20100093785-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2010-04-15 US disclosed
US-20090270446-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-10-29 US disclosed
US-7365205-B2 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-04-29 US disclosed
US-7342014-B2 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-11 US disclosed
US-20080015215-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-01-17 US disclosed
US-20050245565-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 US disclosed
US-20050119486-A1 Diamine derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2005-06-02 US disclosed
US-20050020645-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-01-27 US disclosed
EP-1415992-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 EP disclosed
EP-1405852-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-07 EP 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 (8 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-20090270446-A1 DIAMINE DERIVATIVES F2, TFPI, F3 MAPT 4302/4885NR1H2 3133/4885NR1H3 3196/4885
US-20050020645-A1 Diamine derivatives C9, C1S, C1R MAPT 4271/4885NR1H2 1079/4885NR1H3 1596/4885
US-20080015215-A1 DIAMINE DERIVATIVES C9, C1S, C1R MAPT 4271/4885NR1H2 1079/4885NR1H3 1596/4885
US-20050245565-A1 Diamine derivatives C9, C1S, C1R MAPT 4271/4885NR1H2 1079/4885NR1H3 1596/4885
US-20100093785-A1 DIAMINE DERIVATIVES C9, C1S, C1R MAPT 4343/4885NR1H2 721/4885NR1H3 992/4885
US-20050119486-A1 Diamine derivatives C9, C1S, C1R MAPT 4271/4885NR1H2 1079/4885NR1H3 1596/4885
US-20110077266-A1 Diamine Derivatives F2, TFPI, F3 MAPT 4302/4885NR1H2 3133/4885NR1H3 3196/4885
US-20110312990-A1 Diamine Derivatives C9, C1S, C1R MAPT 4230/4885NR1H2 864/4885NR1H3 1229/4885

“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.