SCHEMBL8030125

SCHEMBL8030125

CO[C@H]1CC2CON[C@@]2(c2ccccc2F)C1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.31
SIGMAR1 Q99720 2/20 0.30

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
SCHEMBL2619833 1.00 BACE1 (0.31) BACE1SIGMAR1
SCHEMBL2619835 1.00 BACE1 (0.31) BACE1SIGMAR1
SCHEMBL8030355 1.00 BACE1 (0.31) BACE1SIGMAR1
SCHEMBL8028581 1.00 BACE1 (0.31) BACE1SIGMAR1
SCHEMBL2631666 0.94 BACE1 (0.34) BACE1SIGMAR1
SCHEMBL2620030 0.94 BACE1 (0.34) BACE1SIGMAR1
SCHEMBL2932891 0.94 BACE1 (0.34) BACE1SIGMAR1
SCHEMBL2619921 0.88 BACE1 (0.33) BACE1SIGMAR1
SCHEMBL8032231 0.88 BACE1 (0.33) BACE1SIGMAR1
SCHEMBL2619922 0.88 BACE1 (0.33) BACE1SIGMAR1

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