SCHEMBL310099

SCHEMBL310099

CC(NC(CCC(F)(F)F)C(N)=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HDAC4 P56524 3/20 0.42
HDAC6 Q9UBN7 3/20 0.42
HDAC3 O15379 2/20 0.42
HDAC1 Q13547 2/20 0.42
POLB P06746 2/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
APAF1 O14727 1/20 0.41
CASR P41180 1/20 0.40
MAPT P10636 1/20 0.40
ACP3 P15309 2/20 0.40

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
SCHEMBL1643461 1.00 MEN1 (0.48) MEN1KMT2AHDAC4HDAC6HDAC3
SCHEMBL1643467 1.00 MEN1 (0.48) MEN1KMT2AHDAC4HDAC6HDAC3
Hydrochloric Acid SCHEMBL310112 0.99 MEN1 (0.47) MEN1KMT2AHDAC4HDAC6HDAC3
Hydrochloric Acid SCHEMBL310111 0.99 MEN1 (0.47) MEN1KMT2AHDAC4HDAC6HDAC3
SCHEMBL15827667 0.86 CTSD (0.44) MEN1KMT2AHDAC4HDAC6HDAC3
SCHEMBL1168970 0.84 POLB (0.49) MEN1KMT2APOLBCTDSP1APAF1
SCHEMBL24298576 0.81 MEN1 (0.49) MEN1KMT2AHDAC4HDAC6HDAC3
SCHEMBL24298577 0.81 MEN1 (0.49) MEN1KMT2AHDAC4HDAC6HDAC3
SCHEMBL17161710 0.80 MEN1 (0.53) MEN1KMT2APOLBCTDSP1APAF1
SCHEMBL7313416 0.80 MAPT (0.44) POLBCTDSP1APAF1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2408757-B1 A NOVEL ALPHA-(N-SULFONAMIDO) ACETAMIDE COMPOUND INCORPORATING DEUTERIUM AS INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION BRISTOL MYERS SQUIBB CO (US) 2014-06-25 EP disclosed
EP-2408450-B1 ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUND AS AN INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION BRISTOL MYERS SQUIBB CO (US) 2013-03-13 EP disclosed
US-8350084-B2 Alpha-(N-sulfonamido)acetamide compound as an inhibitor of beta amyloid peptide production BRISTOL-MYERS SQUIBB COMPANY (US) 2013-01-08 US disclosed
EP-2471769-A1 Process for preparing a benzonitrile derivative Bristol-Myers Squibb Company (US) 2012-07-04 EP disclosed
EP-2295417-B1 Novel intermediates useful for preparing alpha-(n-sulfonamido)acetamide compound BRISTOL MYERS SQUIBB CO (US) 2012-07-04 EP disclosed
US-20120088925-A1 Novel Alpha-(N-Sulfonamido)Acetamide Compound as an Inhibitor of Beta Amyloid Peptide Production BRISTOL-MYERS SQUIBB COMPANY 2012-04-12 US disclosed
EP-2408760-A1 THIOPHENYL SULFONAMIDES FOR THE TREATMENT OF ALZHEIMER'S DISEASE Bristol-Myers Squibb Company (US) 2012-01-25 EP disclosed
US-8093276-B2 Alpha-(N-sulfonamido)acetamide compound as an inhibitor of beta amyloid peptide production BRISTOL-MYERS SQUIBB COMPANY (US) 2012-01-10 US disclosed
US-8084477-B2 Alpha-(N-sulfonamido)acetamide compound as an inhibitor of beta amyloid peptide production BRISTOL-MYERS SQUIBB COMPANY (US) 2011-12-27 US disclosed
US-8044077-B2 Alpha-(N-sulfonamido)acetamide compounds incorporating deuterium as inhibitors of beta amyloid peptide production BRISTOL-MYERS SQUIBB COMPANY (US) 2011-10-25 US disclosed
US-20110071199-A1 Thiophenyl Sulfonamides for the Treatment of Alzheimer's Disease BRISTOL-MYERS SQUIBB COMPANY 2011-03-24 US disclosed
EP-2295417-A1 Novel intermediates useful for preparing alpha-(n-sulfonamido)acetamide compound Bristol-Myers Squibb Company (US) 2011-03-16 EP disclosed
EP-2205575-B1 A NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUND AS AN INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION BRISTOL MYERS SQUIBB CO (US) 2011-03-16 EP disclosed
US-20100240719-A1 NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUNDS INCORPORATING DEUTERIUM AS INHIBITORS OF BETA AMYLOID PEPTIDE PRODUCTION BRISTOL-MYERS SQUIBB COMPANY 2010-09-23 US disclosed
WO-2010107997-A1 THIOPHENYL SULFONAMIDES FOR THE TREATMENT OF ALZHEIMER'S DISEASE BRISTOL-MYERS SQUIBB COMPANY (US) 2010-09-23 WO disclosed
US-20090227642-A1 NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUND AS AN INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION BRISTOL-MYERS SQUIBB COMPANY 2009-09-10 US disclosed
US-20090111858-A1 Novel Alpha-(N-Sulfonamido)Acetamide Compound as an Inhibitor of Beta Amyloid Peptide Production BRISTOL-MYERS SQUIBB COMPANY 2009-04-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 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-20090111858-A1 Novel Alpha-(N-Sulfonamido)Acetamide Compound as an Inhibitor of Beta Amyloid Peptide Production APP, BACE1, IAPP MEN1 2602/4885KMT2A 3438/4885HDAC4 1317/4885
US-20100240719-A1 NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUNDS INCORPORATING DEUTERIUM AS INHIBITORS OF BETA AMYLOID PEPTIDE PRODUCTION APP, BACE1, PSEN1 MEN1 3120/4885KMT2A 3644/4885HDAC4 2277/4885
US-20120088925-A1 Novel Alpha-(N-Sulfonamido)Acetamide Compound as an Inhibitor of Beta Amyloid Peptide Production APP, BACE1, IAPP MEN1 2602/4885KMT2A 3438/4885HDAC4 1317/4885
US-20090227642-A1 NOVEL ALPHA-(N-SULFONAMIDO)ACETAMIDE COMPOUND AS AN INHIBITOR OF BETA AMYLOID PEPTIDE PRODUCTION APP, BACE1, APBA1 MEN1 3330/4885KMT2A 2264/4885HDAC4 2241/4885
US-20110071199-A1 Thiophenyl Sulfonamides for the Treatment of Alzheimer's Disease APP, PSEN1, PSEN2 MEN1 3967/4885KMT2A 2523/4885HDAC4 1768/4885

“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.