SCHEMBL2944484

SCHEMBL2944484

CC(CO)N(OCc1ccccc1)C(=O)OC(C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.50
NPSR1 Q6W5P4 1/20 0.40
HDAC3 O15379 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
NCOR2 Q9Y618 1/20 0.40
SYK P43405 1/20 0.39
PPARA Q07869 1/20 0.39
HTR2C P28335 1/20 0.39
SLC6A4 P31645 1/20 0.39
AKT1 P31749 2/20 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
SCHEMBL8300754 0.86 L3MBTL1 (0.52) L3MBTL1NPSR1HDAC3HDAC1HDAC2
SCHEMBL5862801 0.85 L3MBTL1 (0.49) L3MBTL1NPSR1HDAC3HDAC1HDAC2
SCHEMBL3145649 0.84 L3MBTL1 (0.46) L3MBTL1NPSR1SYKPPARA
SCHEMBL3209123 0.83 ALDH1A1 (0.43) L3MBTL1
SCHEMBL1913579 0.83 L3MBTL1 (0.49) L3MBTL1NPSR1HDAC3HDAC1HDAC2
SCHEMBL1913578 0.83 L3MBTL1 (0.49) L3MBTL1NPSR1HDAC3HDAC1HDAC2
SCHEMBL7616466 0.82 L3MBTL1 (0.51) L3MBTL1NPSR1HDAC3HDAC1HDAC2
SCHEMBL15320116 0.82 NPSR1 (0.52) L3MBTL1NPSR1HDAC3HDAC1HDAC2
SCHEMBL15318909 0.82 NPSR1 (0.52) L3MBTL1NPSR1HDAC3HDAC1HDAC2
SCHEMBL8362357 0.81 L3MBTL1 (0.47) L3MBTL1NPSR1HDAC3HDAC1HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7754886-B2 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES (US) 2010-07-13 US disclosed
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2009-05-28 US disclosed
EP-1318978-B1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LAB (US) 2006-02-08 EP disclosed
US-6720338-B2 BCL-X1 INHIBITING COMPOSITIONS AND METHODS OF PROMOTING APOPTOSIS IN A MAMMAL ABBOTT LABORATORIES 2004-04-13 US disclosed
US-20020086887-A1 N-Acylsulfonamide apoptosis promoters ABBVIE INC. 2002-07-04 US disclosed
US-20020055631-A1 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES 2002-05-09 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 (3 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-20020086887-A1 N-Acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 L3MBTL1 189/4885NPSR1 2840/4885HDAC3 436/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 L3MBTL1 107/4885NPSR1 3282/4885HDAC3 276/4885
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BCOR L3MBTL1 138/4885NPSR1 3274/4885HDAC3 178/4885

“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.