SCHEMBL375537

SCHEMBL375537

CCN(c1ccccc1)C(CCC(F)(F)F)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 9/20 0.42
NR1H3 Q13133 9/20 0.42
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
TSHR P16473 1/20 0.39
PSEN1 P49768 8/20 0.38
PSEN2 P49810 8/20 0.38
APH1B Q8WW43 8/20 0.38
NCSTN Q92542 8/20 0.38
APH1A Q96BI3 8/20 0.38
PSENEN Q9NZ42 8/20 0.38

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
Hydrochloric Acid SCHEMBL374900 0.99 NR1H2 (0.41) NR1H2NR1H3ALDH1A1GLATSHR
SCHEMBL379646 0.85 ALDH1A1 (0.43) NR1H2NR1H3ALDH1A1GLATSHR
SCHEMBL18203139 0.84 NR1H2 (0.43) NR1H2NR1H3ALDH1A1GLATSHR
SCHEMBL28092851 0.79 ALDH1A1 (0.43) NR1H2NR1H3ALDH1A1GLATSHR
SCHEMBL2754132 0.78 NR1H2 (0.45) NR1H2NR1H3ALDH1A1GLATSHR
SCHEMBL4667661 0.73 ALDH1A1 (0.47) NR1H2NR1H3ALDH1A1GLATSHR
SCHEMBL11763140 0.72 ALDH1A1 (0.46) NR1H2NR1H3ALDH1A1GLATSHR
SCHEMBL375591 0.72 NR1H2 (0.40) NR1H2NR1H3ALDH1A1GLATSHR
SCHEMBL9324872 0.72 TSHR (0.48) NR1H2NR1H3ALDH1A1GLATSHR
SCHEMBL6237043 0.71 NR1H2 (0.50) NR1H2NR1H3ALDH1A1GLATSHR

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
EP-2408757-A1 NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUNDS INCORPORATING DEUTERIUM AS INHIBITORS OF BETA AMYLOID PEPTIDE PRODUCTION A NOVEL ALPHA-(N-SULFONAMIDO) ACETAMIDE COMPOUND INCORPORATING DEUTERIUM AS INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION Bristol-Myers Squibb Company (US) 2012-01-25 EP disclosed
WO-2010107984-A1 NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUNDS INCORPORATING DEUTERIUM AS INHIBITORS OF BETA AMYLOID PEPTIDE PRODUCTION A NOVEL ALPHA-(N-SULFONAMIDO) ACETAMIDE COMPOUND INCORPORATING DEUTERIUM AS INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2010-09-23 WO disclosed
EP-2205575-A1 A NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUND AS AN INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION Bristol-Myers Squibb Company (US) 2010-07-14 EP disclosed
WO-2009058552-A1 A NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUND AS AN INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION BRISTOL-MYERS SQUIBB COMPANY (US) 2009-05-07 WO disclosed