SCHEMBL3299374

SCHEMBL3299374

CC1COCC2(c3cc(NC(=O)c4cnc(C(F)F)cn4)ccc3F)N=C(N)SCC12

nearest known ligand 0.81

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 16/20 0.81
BACE2 Q9Y5Z0 7/20 0.64
KCNH2 Q12809 3/20 0.57
CYP2D6 P10635 2/20 0.57

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
SCHEMBL3299378 1.00 BACE1 (0.81) BACE1BACE2KCNH2CYP2D6
SCHEMBL1934647 0.92 BACE1 (0.77) BACE1BACE2KCNH2CYP2D6
Elenbecestat SCHEMBL2933223 0.89 BACE1 (1.00) BACE1BACE2KCNH2CYP2D6
Elenbecestat SCHEMBL29359992 0.89 BACE1 (1.00) BACE1BACE2KCNH2CYP2D6
Elenbecestat SCHEMBL30477102 0.89 BACE1 (1.00) BACE1BACE2KCNH2CYP2D6
Elenbecestat SCHEMBL2620149 0.89 BACE1 (1.00) BACE1BACE2KCNH2CYP2D6
SCHEMBL2932423 0.89 BACE1 (0.78) BACE1BACE2KCNH2CYP2D6
SCHEMBL2620131 0.89 BACE1 (0.78) BACE1BACE2KCNH2CYP2D6
SCHEMBL3300707 0.89 BACE1 (0.64) BACE1BACE2KCNH2CYP2D6
SCHEMBL3300712 0.89 BACE1 (0.64) BACE1BACE2KCNH2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8198269-B2 Fused aminodihydrothiazine derivative EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-06-12 US claimed
EP-2332943-B1 NOVEL FUSED AMINODIHYDROTHIAZINE DERIVATIVE EISAI R&D MAN CO LTD (JP) 2015-04-22 EP disclosed
US-20100093999-A1 NOVEL FUSED AMINODIHYDROTHIAZINE DERIVATIVE EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-04-15 US disclosed
WO-2010038686-A1 NOVEL FUSED AMINODIHYDROTHIAZINE DERIVATIVE エーザイ・アール・アンド・ディー・マネジメント株式会社 (JP) 2010-04-08 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 (1 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-20100093999-A1 NOVEL FUSED AMINODIHYDROTHIAZINE DERIVATIVE BACE1, BACE2, APP BACE1 1/4885BACE2 2/4885KCNH2 1984/4885

“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.