SCHEMBL15938768

SCHEMBL15938768

C/C=C/C[C@H](COCc1ccccc1)OCC=NO

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.44
MAPT P10636 1/20 0.38
CA1 P00915 4/20 0.38
CA2 P00918 2/20 0.38
CA7 P43166 2/20 0.38
CA9 Q16790 2/20 0.38
RGS12 O14924 1/20 0.35
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
FOLH1 Q04609 1/20 0.35
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.34
TSHR P16473 1/20 0.34
TACR1 P25103 2/20 0.34
RCE1 Q9Y256 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
SCHEMBL15366798 1.00 HTT (0.44) HTTMAPTCA1CA2CA7
SCHEMBL15366799 1.00 HTT (0.44) HTTMAPTCA1CA2CA7
SCHEMBL15939074 0.85 MAPT (0.44) HTTMAPTCA1CA2CA7
SCHEMBL15939073 0.85 MAPT (0.44) HTTMAPTCA1CA2CA7
SCHEMBL15939072 0.85 MAPT (0.44) HTTMAPTCA1CA2CA7
SCHEMBL1934778 0.85 TDP1 (0.40) HTTMAPTCA1CA2CA7
SCHEMBL1934779 0.85 TDP1 (0.40) HTTMAPTCA1CA2CA7
SCHEMBL15944534 0.84 MAPT (0.46) HTTMAPTAPOBEC3AAPOBEC3GFOLH1
SCHEMBL15373038 0.83 HTT (0.44) HTTMAPTCA1CA2CA7
SCHEMBL15366495 0.83 HTT (0.44) HTTMAPTCA1CA2CA7

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-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-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-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-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-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
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
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 HTT 141/4885MAPT 78/4885CA1 3164/4885
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 HTT 141/4885MAPT 78/4885CA1 3164/4885
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 HTT 141/4885MAPT 78/4885CA1 3164/4885

“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.