SCHEMBL17501064

SCHEMBL17501064

CC(C)(O)C(C)(C)OB(O)c1ccc(S(C)(=O)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.53
PTGS2 P35354 6/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
GPR119 Q8TDV5 1/20 0.33
RIPK1 Q13546 1/20 0.33
EPHX2 P34913 1/20 0.32
NR1H4 Q96RI1 1/20 0.32

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
SCHEMBL790008 0.86 CA2 (0.43)
SCHEMBL29267529 0.85 ENPP2 (0.58) ENPP2PTGS2SMN1; SMN2GPR119RIPK1
SCHEMBL17394036 0.83 LMNA (0.44) ENPP2SMN1; SMN2
SCHEMBL1365908 0.83 ALDH1A1 (0.46) ENPP2SMN1; SMN2GPR119
SCHEMBL16734814 0.82 ALDH1A1 (0.44) SMN1; SMN2
SCHEMBL1838200 0.80 SMN1; SMN2 (0.42) SMN1; SMN2
SCHEMBL6609666 0.80 ALDH1A1 (0.43) PTGS2SMN1; SMN2GPR119
SCHEMBL19433226 0.79 CA2 (0.42) ENPP2
SCHEMBL15367415 0.78 ENPP2 (0.33) ENPP2GPR119
SCHEMBL16734881 0.78 GAA (0.52) SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3672958-B1 ANNULATED GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2023-08-02 EP disclosed
US-11458140-B2 Annulated glycosidase inhibitors ASCENEURON SA (CH) 2022-10-04 US disclosed
EP-3395818-B1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES Bayer Pharma AG (DE) 2021-09-22 EP disclosed
US-20200289516-A1 ANNULATED GLYCOSIDASE INHIBITORS ASCENEURON SA (CH) 2020-09-17 US disclosed
US-10772893-B2 2-(morpholin-4-yl)-1,7-naphthyridines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-09-15 US disclosed
EP-3672958-A1 ANNULATED GLYCOSIDASE INHIBITORS Asceneuron SA (CH) 2020-07-01 EP disclosed
WO-2019037861-A1 ANNULATED GLYCOSIDASE INHIBITORS Asceneuron S.A. (CH) 2019-02-28 WO disclosed
EP-3395818-A1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES Bayer Pharma Aktiengesellschaft (DE) 2018-10-31 EP disclosed
US-20180256591-A1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-09-13 US disclosed
US-9993484-B2 2-(morpholin-4-yl)-1,7-naphthyridines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-06-12 US disclosed
EP-3177619-B1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES Bayer Pharma AG (DE) 2018-04-25 EP disclosed
US-20170216304-A1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-08-03 US disclosed
EP-3177619-A1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES Bayer Pharma Aktiengesellschaft (DE) 2017-06-14 EP disclosed
US-9549932-B2 2-(morpholin-4-yl)-1,7-naphthyridines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-01-24 US disclosed
US-20160287604-A1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-10-06 US disclosed
WO-2016020320-A1 2-(MORPHOLIN-4-YL)-L,7-NAPHTHYRIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2016-02-11 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 (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-20200289516-A1 ANNULATED GLYCOSIDASE INHIBITORS GAA, GBA3, ENGASE ENPP2 123/4885PTGS2 4244/4885SMN1; SMN2 1271/4885
US-11458140-B2 Annulated glycosidase inhibitors GAA, GBA3, ENGASE ENPP2 123/4885PTGS2 4244/4885SMN1; SMN2 1271/4885
US-20180256591-A1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES POLQ, CCND2, NRAS ENPP2 1618/4885PTGS2 2043/4885SMN1; SMN2 291/4885
US-20170216304-A1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES POLQ, CCND2, NRAS ENPP2 1618/4885PTGS2 2043/4885SMN1; SMN2 291/4885
US-20160287604-A1 2-(MORPHOLIN-4-YL)-1,7-NAPHTHYRIDINES POLQ, CCND2, NRAS ENPP2 1618/4885PTGS2 2043/4885SMN1; SMN2 291/4885
US-10772893-B2 2-(morpholin-4-yl)-1,7-naphthyridines POLQ, CCND2, NRAS ENPP2 1618/4885PTGS2 2043/4885SMN1; SMN2 291/4885

“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.