SCHEMBL2926283

SCHEMBL2926283

O=C(O)NC1=N[C@@]2(c3cc([N+](=O)[O-])ccc3F)CC[C@@H](F)C[C@@H]2CS1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 12/20 0.37
BACE2 Q9Y5Z0 4/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
KCNH2 Q12809 1/20 0.33
ALDH1A1 P00352 2/20 0.33
HIF1A Q16665 1/20 0.32

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
SCHEMBL2930931 1.00 BACE1 (0.37) BACE1BACE2L3MBTL1MAPTKMT2A
SCHEMBL2926285 1.00 BACE1 (0.37) BACE1BACE2L3MBTL1MAPTKMT2A
SCHEMBL2926278 1.00 BACE1 (0.37) BACE1BACE2L3MBTL1MAPTKMT2A
SCHEMBL2932804 1.00 BACE1 (0.37) BACE1BACE2L3MBTL1MAPTKMT2A
SCHEMBL2930929 1.00 BACE1 (0.37) BACE1BACE2L3MBTL1MAPTKMT2A
SCHEMBL2932805 1.00 BACE1 (0.37) BACE1BACE2L3MBTL1MAPTKMT2A
SCHEMBL3773623 0.92 L3MBTL1 (0.36) BACE1BACE2L3MBTL1MAPTKMT2A
SCHEMBL3773618 0.92 L3MBTL1 (0.36) BACE1BACE2L3MBTL1MAPTKMT2A
SCHEMBL3773622 0.92 L3MBTL1 (0.36) BACE1BACE2L3MBTL1MAPTKMT2A
SCHEMBL3774085 0.88 BACE1 (0.47) BACE1BACE2L3MBTL1MAPTKMT2A

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
EP-2233474-A1 CONDENSED AMINODIHYDROTHIAZINE DERIVATIVE Eisai R&D Management Co., Ltd. (JP) 2010-09-29 EP disclosed