SCHEMBL2385223

SCHEMBL2385223

NC1=N[C@@]2(CO1)c1cc(-c3cccc(Cl)c3F)ccc1Oc1ncc(C3=CCOCC3)cc12

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.78
CTSD P07339 5/20 0.62
KCNH2 Q12809 6/20 0.61
BACE2 Q9Y5Z0 1/20 0.50

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
SCHEMBL15509595 0.89 BACE1 (0.82) BACE1CTSDKCNH2BACE2
SCHEMBL1995658 0.88 BACE1 (0.76) BACE1CTSDKCNH2
SCHEMBL1995661 0.88 BACE1 (0.76) BACE1CTSDKCNH2
SCHEMBL15509475 0.87 BACE1 (1.00) BACE1CTSDKCNH2BACE2
SCHEMBL15509657 0.87 BACE1 (0.77) BACE1CTSDKCNH2
SCHEMBL15510249 0.87 BACE1 (0.71) BACE1CTSDKCNH2
SCHEMBL15509854 0.85 BACE1 (0.77) BACE1CTSDKCNH2
SCHEMBL15509528 0.85 BACE1 (0.76) BACE1CTSDKCNH2
SCHEMBL15509984 0.84 BACE1 (0.75) BACE1CTSDKCNH2
SCHEMBL15509652 0.84 BACE1 (0.75) BACE1CTSDKCNH2

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-8883782-B2 Spiro-tetracyclic ring compounds as beta-secretase modulators and methods of use AMGEN INC. (US) 2014-11-11 US claimed
EP-2547685-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA - SECRETASE MODULATORS Amgen Inc. (US) 2013-01-23 EP claimed
US-20110251190-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2011-10-13 US claimed
WO-2011115938-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA - SECRETASE MODULATORS AMGEN INC. (US) 2011-09-22 WO claimed

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-20110251190-A1 SPIRO-TETRACYCLIC RING COMPOUNDS AS BETA-SECRETASE MODULATORS AND METHODS OF USE BACE1, BACE2, APP BACE1 1/4885CTSD 680/4885KCNH2 3129/4885

“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.