SCHEMBL15939072

SCHEMBL15939072

O=C(O)/C=C/C[C@H](COCc1ccccc1)OC/C=N/O

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.44
HCAR2 Q8TDS4 1/20 0.39
HTT P42858 1/20 0.38
SLC1A1 P43005 1/20 0.37
FOLH1 Q04609 1/20 0.36
TBXAS1 P24557 1/20 0.36
CA1 P00915 3/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
ALDH1A1 P00352 1/20 0.34
PTGER1 P34995 1/20 0.34
PTGER4 P35408 1/20 0.34
PTGER3 P43115 1/20 0.34
PTGER2 P43116 1/20 0.34
MAPK1 P28482 1/20 0.33
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33

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
SCHEMBL15939073 1.00 MAPT (0.44) MAPTHCAR2HTTSLC1A1FOLH1
SCHEMBL15939074 1.00 MAPT (0.44) MAPTHCAR2HTTSLC1A1FOLH1
SCHEMBL15944534 0.89 MAPT (0.46) MAPTHTTSLC1A1FOLH1APOBEC3A
SCHEMBL15366799 0.85 HTT (0.44) MAPTHTTFOLH1CA1CA2
SCHEMBL15938768 0.85 HTT (0.44) MAPTHTTFOLH1CA1CA2
SCHEMBL15366798 0.85 HTT (0.44) MAPTHTTFOLH1CA1CA2
SCHEMBL1934779 0.83 TDP1 (0.40) MAPTHTTSLC1A1FOLH1CA1
SCHEMBL1934778 0.83 TDP1 (0.40) MAPTHTTSLC1A1FOLH1CA1
SCHEMBL16285987 0.79 MAPT (0.46) MAPTHTTSLC1A1FOLH1APOBEC3A
SCHEMBL15938941 0.79 MAPT (0.47) MAPTHCAR2HTTSLC1A1FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2956458-B1 HETEROARYL-SUBSTITUTED HEXAHYDROPYRANO[3,4-D][1,3]THIAZIN-2-AMINE COMPOUNDS PFIZER (US) 2017-08-09 EP disclosed
EP-2956458-A1 HETEROARYL-SUBSTITUTED HEXAHYDROPYRANO [3,4-d][1,3]THIAZIN-2-AMINE COMPOUNDS Pfizer Inc. (US) 2015-12-23 EP disclosed
US-9192612-B2 Heteroaryl-substituted hexahydropyrano[3,4-d][1,3]thiazin-2-amine compounds PFIZER INC. (US) 2015-11-24 US disclosed
US-20150224110-A1 Heteroaryl-Substituted Hexahydropyrano[3,4-d][1,3]Thiazin-2-Amine Compounds PFIZER INC. (US) 2015-08-13 US disclosed
US-9045499-B2 Heteroaryl-substituted hexahydropyrano[3,4-d][1,3]thiazin-2-amine compounds PFIZER INC. (US) 2015-06-02 US disclosed
US-20140364426-A1 Heteroaryl-Substituted Hexahydropyrano[3,4-d][1,3]Thiazin-2-Amine Compounds PFIZER (US) 2014-12-11 US disclosed
US-8865706-B2 Heteroaryl-substituted hexahydropyrano[3,4-d][1,3]thiazin-2-amine compounds PFIZER INC. (US) 2014-10-21 US disclosed
WO-2014125394-A1 HETEROARYL-SUBSTITUTED HEXAHYDROPYRANO [3,4-d][1,3] THIAZIN-2-AMINE COMPOUNDS PFIZER INC. (US) 2014-08-21 WO disclosed
US-20140228356-A1 Heteroaryl-Substituted Hexahydropyrano[3,4-d][1,3]Thiazin-2-Amine Compounds PFIZER INC. (US) 2014-08-14 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 (3 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-20140228356-A1 Heteroaryl-Substituted Hexahydropyrano[3,4-d][1,3]Thiazin-2-Amine Compounds TBXA2R, UGT1A3, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 MAPT 78/4885HCAR2 350/4885HTT 141/4885
US-20150224110-A1 Heteroaryl-Substituted Hexahydropyrano[3,4-d][1,3]Thiazin-2-Amine Compounds TBXA2R, UGT1A3, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 MAPT 78/4885HCAR2 350/4885HTT 141/4885
US-20140364426-A1 Heteroaryl-Substituted Hexahydropyrano[3,4-d][1,3]Thiazin-2-Amine Compounds TBXA2R, UGT1A3, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 MAPT 78/4885HCAR2 350/4885HTT 141/4885

“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.