SCHEMBL1161702

SCHEMBL1161702

CS(=O)(=O)NC(=O)CCN

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.38
CXCL8 P10145 1/20 0.38
NR4A2 P43354 1/20 0.38
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37
CA2 P00918 2/20 0.36
CA1 P00915 1/20 0.36
CA4 P22748 1/20 0.36
RBP4 P02753 1/20 0.35
LTA4H P09960 1/20 0.35
PLA2G10 O15496 1/20 0.35
TERT O14746 2/20 0.34
KDM1A O60341 2/20 0.33
PTGES O14684 1/20 0.33
FNTA P49354 1/20 0.32
FNTB P49356 1/20 0.32
KCNK2 O95069 1/20 0.31
CTSD P07339 1/20 0.31
TRPA1 O75762 1/20 0.31

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
SCHEMBL6631399 0.86 EPHX2 (0.43) EPHX2CA2CA1CA4PTGES
SCHEMBL6846135 0.80
Hydrochloric Acid SCHEMBL31301878 0.78 CA2 (0.40) EPHX2CXCL8CA2CA1
SCHEMBL6015 0.78 HDAC3 (0.50) EPHX2NR4A2CA2CA1CA4
SCHEMBL16353784 0.76 PHF8 (0.48) EPHX2NR4A2CA2CA1CA4
SCHEMBL7737980 0.76 EPHX2 (0.38) EPHX2CXCL8NR4A2MTNR1AMTNR1B
SCHEMBL3897925 0.76 EPHX2 (0.38) EPHX2CXCL8NR4A2MTNR1AMTNR1B
SCHEMBL23792182 0.76 TERT (0.35) CA2CA1CA4TERTKDM1A
SCHEMBL19955899 0.75 CA2 (0.36) EPHX2CXCL8NR4A2CA2PLA2G10
SCHEMBL6887420 0.74 EPHX2 (0.55) EPHX2CA2CA1PTGES

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190209592-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN MA INC. 2019-07-11 US disclosed
US-20190209592-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN MA INC. 2019-07-11 US disclosed
US-10166250-B2 Bicyclic aryl sphingosine 1-phosphate analogs BIOGEN MA INC. (US) 2019-01-01 US disclosed
US-10166250-B2 Bicyclic aryl sphingosine 1-phosphate analogs BIOGEN MA INC. (US) 2019-01-01 US disclosed
US-20180133233-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN MA INC. 2018-05-17 US disclosed
US-20180133233-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN MA INC. 2018-05-17 US disclosed
US-20180133233-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN MA INC. 2018-05-17 US disclosed
US-9827258-B2 Bicyclic aryl sphingosine 1-phosphate analogs BIOGEN MA INC. (US) 2017-11-28 US disclosed
US-9827258-B2 Bicyclic aryl sphingosine 1-phosphate analogs BIOGEN MA INC. (US) 2017-11-28 US disclosed
US-9827258-B2 Bicyclic aryl sphingosine 1-phosphate analogs BIOGEN MA INC. (US) 2017-11-28 US disclosed
US-20140309190-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN IDEC MA INC. (US) 2014-10-16 US disclosed
US-8802659-B2 Bicyclic aryl sphingosine 1-phosphate analogs BIOGEN IDEC MA INC. (US) 2014-08-12 US disclosed
US-8802659-B2 Bicyclic aryl sphingosine 1-phosphate analogs BIOGEN IDEC MA INC. (US) 2014-08-12 US disclosed
US-8802659-B2 Bicyclic aryl sphingosine 1-phosphate analogs BIOGEN IDEC MA INC. (US) 2014-08-12 US disclosed
US-20120190649-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN IDEC MA INC. (US) 2012-07-26 US disclosed
US-20120190649-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN IDEC MA INC. (US) 2012-07-26 US disclosed
EP-2461683-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS Biogen Idec MA Inc. (US) 2012-06-13 EP disclosed
WO-2011017561-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS BIOGEN IDEC MA INC. (US) 2011-02-10 WO disclosed
US-20070105924-A1 Vigabatrin bioisoteres and related methods of use NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2007-05-10 US disclosed
US-20070105924-A1 Vigabatrin bioisoteres and related methods of use NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2007-05-10 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 (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-20140309190-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS S1PR1, S1PR3, S1PR4 EPHX2 3322/4885CXCL8 3289/4885NR4A2 1055/4885
US-20180133233-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS S1PR1, S1PR3, S1PR4 EPHX2 3322/4885CXCL8 3289/4885NR4A2 1055/4885
US-20120190649-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS S1PR1, S1PR3, S1PR4 EPHX2 2292/4885CXCL8 3941/4885NR4A2 559/4885
US-10166250-B2 Bicyclic aryl sphingosine 1-phosphate analogs S1PR1, S1PR3, S1PR4 EPHX2 3322/4885CXCL8 3289/4885NR4A2 1055/4885
US-20070105924-A1 Vigabatrin bioisoteres and related methods of use GABRB3, GABRB2, GABRE EPHX2 1967/4885CXCL8 4188/4885NR4A2 2981/4885
US-20190209592-A1 BICYCLIC ARYL SPHINGOSINE 1-PHOSPHATE ANALOGS S1PR1, S1PR3, S1PR4 EPHX2 2292/4885CXCL8 3941/4885NR4A2 559/4885

“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.