SCHEMBL8031409

SCHEMBL8031409

NC1=N[C@@]2(c3ccccc3F)CCCCCC2CS1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 20/20 0.65
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
SCHEMBL2619817 1.00 BACE1 (0.65) BACE1BACE2
SCHEMBL2932082 1.00 BACE1 (0.65) BACE1BACE2
SCHEMBL2622801 0.99 BACE1 (0.67) BACE1BACE2
SCHEMBL2619805 0.99 BACE1 (0.67) BACE1BACE2
SCHEMBL2632261 0.99 BACE1 (0.67) BACE1BACE2
SCHEMBL2932054 0.95 BACE1 (0.68) BACE1BACE2
SCHEMBL2619802 0.95 BACE1 (0.68) BACE1BACE2
SCHEMBL16418318 0.95 BACE1 (0.68) BACE1BACE2
SCHEMBL2933287 0.89 BACE1 (0.55) BACE1BACE2
SCHEMBL2619810 0.89 BACE1 (0.55) BACE1BACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2009091016-A1 CONDENSED AMINODIHYDROTHIAZINE DERIVATIVE EISAI R & D MANAGEMENT CO., LTD. (JP) 2009-07-23 WO disclosed