SCHEMBL2933418

SCHEMBL2933418

CC1OCCC2(c3cc(NC(=O)c4cnc(OC(F)F)cn4)ccc3F)N=C(N)SCC12

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 16/20 0.71
KCNH2 Q12809 3/20 0.61
CYP2D6 P10635 2/20 0.61
BACE2 Q9Y5Z0 9/20 0.58
CTSD P07339 1/20 0.54

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
SCHEMBL2620236 1.00 BACE1 (0.71) BACE1KCNH2CYP2D6BACE2CTSD
SCHEMBL8033593 0.93 BACE1 (0.80) BACE1KCNH2CYP2D6BACE2CTSD
SCHEMBL2620146 0.93 BACE1 (0.80) BACE1KCNH2CYP2D6BACE2CTSD
SCHEMBL3773173 0.93 BACE1 (0.80) BACE1KCNH2CYP2D6BACE2CTSD
SCHEMBL3778164 0.91 BACE1 (0.73) BACE1KCNH2CYP2D6BACE2
SCHEMBL2620237 0.91 BACE1 (0.73) BACE1KCNH2CYP2D6BACE2
SCHEMBL2620235 0.90 BACE1 (0.70) BACE1KCNH2CYP2D6BACE2
SCHEMBL8030222 0.90 BACE1 (0.70) BACE1KCNH2CYP2D6BACE2
SCHEMBL4363011 0.90 BACE1 (0.70) BACE1KCNH2CYP2D6BACE2
SCHEMBL8030450 0.90 BACE1 (0.58) BACE1KCNH2CYP2D6BACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2233474-B1 CONDENSED AMINODIHYDROTHIAZINE DERIVATIVE EISAI R&D MAN CO LTD (JP) 2015-08-05 EP disclosed
US-8946210-B2 Fused aminodihydrothiazine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-02-03 US disclosed
US-8946211-B2 Fused aminodihydrothiazine derivatives EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-02-03 US disclosed
US-20130203741-A1 FUSED AMINODIHYDROTHIAZINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2013-08-08 US disclosed
US-20100317850-A1 CONDENSED AMINODIHYDROTHIAZINE DERIVATIVE EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-12-16 US disclosed
EP-2233474-A1 CONDENSED AMINODIHYDROTHIAZINE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2010-09-29 EP disclosed
US-20090209755-A1 FUSED AMINODIHYDROTHIAZINE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-08-20 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-20130203741-A1 FUSED AMINODIHYDROTHIAZINE DERIVATIVES BACE1, APP, BACE2 BACE1 1/4885KCNH2 2010/4885CYP2D6 1422/4885
US-20090209755-A1 FUSED AMINODIHYDROTHIAZINE DERIVATIVES BACE1, APP, BACE2 BACE1 1/4885KCNH2 2010/4885CYP2D6 1422/4885
US-20100317850-A1 CONDENSED AMINODIHYDROTHIAZINE DERIVATIVE BACE1, APP, BACE2 BACE1 1/4885KCNH2 2256/4885CYP2D6 2480/4885

“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.