SCHEMBL355901

SCHEMBL355901

CCOC(=O)N=NC(=O)O.c1ccc(P(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GAA P10253 2/20 0.42
POLB P06746 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TSHR P16473 2/20 0.41
NPC1 O15118 1/20 0.41
CYP3A4 P08684 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PIN1 Q13526 2/20 0.38
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
CES2 O00748 1/20 0.37
ACHE P22303 1/20 0.37
CES1 P23141 1/20 0.37

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
SCHEMBL4398048 0.95 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2GAAPOLBMEN1
SCHEMBL263877 0.95 ALDH1A1 (0.47) ALDH1A1SMN1; SMN2GAAPOLBMEN1
Benzoic Acid SCHEMBL8538259 0.88 TSHR (0.42) ALDH1A1SMN1; SMN2GAAPOLBMEN1
SCHEMBL28863351 0.88 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2GAAPOLBMEN1
Benzoic Acid SCHEMBL8538257 0.88 TSHR (0.42) ALDH1A1SMN1; SMN2GAAPOLBMEN1
SCHEMBL28418300 0.83 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2GAAPOLBMEN1
SCHEMBL9452987 0.83 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2GAAPOLBMEN1
SCHEMBL23036792 0.80 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2GAAPOLBMEN1
SCHEMBL15419478 0.80 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2GAAPOLBMEN1
SCHEMBL904626 0.80 ALDH1A1 (0.43) ALDH1A1SMN1; SMN2GAAPOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1368309-A2 THIOL-MODIFIED HYALURONAN Anika Therapeutics Inc. (US) 2003-12-10 EP claimed
WO-2002068383-A2 THIOL-MODIFIED HYALURONAN ANIKA THERAPEUTICS, INC. (US) 2002-09-06 WO claimed
EP-2597087-B1 Dihydrooxazine and tetrahydropyrimidine derivatives as BACE 1 inhibitors SHIONOGI & CO (JP) 2016-03-30 EP disclosed
US-20150210680-A1 AMINODIHYDROTHIAZINE DERIVATIVES SHIONOGI & CO (JP) 2015-07-30 US disclosed
US-9029358-B2 Aminodihydrothiazine derivatives SHIONOGI & CO., LTD. (JP) 2015-05-12 US disclosed
EP-2612854-B1 Aminothiazolidine and aminotetrahydrothiazepine derivatives as BACE 1 inhibitors SHIONOGI & CO (JP) 2015-04-29 EP disclosed
US-8895548-B2 Pharmaceutical composition for treating alzheimer's disease SHIONOGI & CO., LTD. (JP) 2014-11-25 US disclosed
US-8815851-B2 Aminodihydrothiazine derivatives SHIONOGI & CO., LTD. (JP) 2014-08-26 US disclosed
EP-1942105-B1 AMINODIHYDROTHIAZINE DERIVATIVE SHIONOGI & CO (JP) 2014-04-16 EP disclosed
US-20140058097-A1 PHARMACEUTICAL COMPOSITION FOR TREATING ALZHEIMER'S DISEASE SHIONOGI & CO., LTD. (JP) 2014-02-27 US disclosed
US-8653067-B2 Pharmaceutical composition for treating Alzheimer's disease SHIONOGI & CO., LTD. (JP) 2014-02-18 US disclosed
US-20130158260-A1 AMINODIHYDROTHIAZINE DERIVATIVES SHIONOGI & CO., LTD. (JP) 2013-06-20 US disclosed
EP-2597087-A1 Dihydrooxazine and tetrahydropyrimidine derivatives as BACE 1 inhibitors Shionogi&Co., Ltd. (JP) 2013-05-29 EP disclosed
US-8173642-B2 Aminodihydrothiazine derivatives SHIONOGI & CO., LTD. (JP) 2012-05-08 US disclosed
US-20120022249-A1 AMINODIHYDROTHIAZINE DERIVATIVES SHIONOGI & CO., LTD. (JP) 2012-01-26 US disclosed
US-20120016116-A1 AMINODIHYDROTHIAZINE DERIVATIVES SHIONOGI & CO., LTD. (JP) 2012-01-19 US disclosed
US-20100160290-A1 PHARMACEUTICAL COMPOSITION FOR TREATING ALZHEIMER'S DISEASE SHIONOGI & CO., LTD. (JP) 2010-06-24 US disclosed
EP-2151435-A1 PHARMACEUTICAL COMPOSITION FOR TREATMENT OF ALZHEIMER'S DISEASE Shionogi&Co., Ltd. (JP) 2010-02-10 EP disclosed
US-20090082560-A1 AMINODIHYDROTHIAZINE DERIVATIVES SHIONOGI & CO., LTD. (JP) 2009-03-26 US disclosed
EP-1942105-A1 AMINODIHYDROTHIAZINE DERIVATIVE Shionogi Co., Ltd. (JP) 2008-07-09 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 (7 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-20120016116-A1 AMINODIHYDROTHIAZINE DERIVATIVES BACE1, BACE2, APP ALDH1A1 1897/4885SMN1; SMN2 2228/4885GAA 1928/4885
US-20100160290-A1 PHARMACEUTICAL COMPOSITION FOR TREATING ALZHEIMER'S DISEASE NR1H2, NR1H3, NR0B1 ALDH1A1 2485/4885SMN1; SMN2 1376/4885GAA 2383/4885
US-20130158260-A1 AMINODIHYDROTHIAZINE DERIVATIVES BACE1, BACE2, APP ALDH1A1 1242/4885SMN1; SMN2 1042/4885GAA 930/4885
US-20140058097-A1 PHARMACEUTICAL COMPOSITION FOR TREATING ALZHEIMER'S DISEASE NR1H2, NR1H3, NR0B1 ALDH1A1 2665/4885SMN1; SMN2 1359/4885GAA 2550/4885
US-20120022249-A1 AMINODIHYDROTHIAZINE DERIVATIVES BACE1, BACE2, APP ALDH1A1 1897/4885SMN1; SMN2 2228/4885GAA 1928/4885
US-20150210680-A1 AMINODIHYDROTHIAZINE DERIVATIVES BACE1, BACE2, APP ALDH1A1 1897/4885SMN1; SMN2 2228/4885GAA 1928/4885
US-20090082560-A1 AMINODIHYDROTHIAZINE DERIVATIVES BACE1, BACE2, APP ALDH1A1 1897/4885SMN1; SMN2 2228/4885GAA 1928/4885

“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.