SCHEMBL2945959

SCHEMBL2945959

CC(CSc1ccccc1)N(O)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 4/20 0.44
MTNR1B P49286 4/20 0.44
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
FFAR1 O14842 1/20 0.37
HTR2C P28335 1/20 0.35
SLC6A4 P31645 1/20 0.35
PPARG P37231 3/20 0.35
PPARA Q07869 3/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
EGFR P00533 1/20 0.35
ELANE P08246 1/20 0.35
PPARD Q03181 2/20 0.34
MMP13 P45452 1/20 0.34

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
SCHEMBL3145649 0.80 L3MBTL1 (0.46) MTNR1AMTNR1BPPARGPPARAL3MBTL1
SCHEMBL1134231 0.78 ATM (0.45) MAOBSLC6A4L3MBTL1
SCHEMBL4441034 0.78 ATM (0.45) MAOBSLC6A4L3MBTL1
SCHEMBL4441036 0.78 ATM (0.45) MAOBSLC6A4L3MBTL1
SCHEMBL9404273 0.73 MTNR1A (0.64) MTNR1AMTNR1BPPARGPPARAPPARD
SCHEMBL8910228 0.73 MTNR1A (0.64) MTNR1AMTNR1BPPARGPPARAPPARD
SCHEMBL16914053 0.73 ALOX5 (0.57)
SCHEMBL26830782 0.73 HTR2C (0.41) MTNR1AMTNR1BMAOAMAOBHTR2C
SCHEMBL8771976 0.73 FDPS (0.38) MTNR1AMTNR1BMAOAMAOBSLC6A4
SCHEMBL8771961 0.71 FDPS (0.36) MTNR1AMTNR1BMAOAMAOBSLC6A4

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 8 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
US-7504512-B2 N-acylsulfonamide apoptosis promoters ABBOTT LABORATORIES (US) 2009-03-17 US disclosed
EP-1318978-B1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LAB (US) 2006-02-08 EP disclosed
US-20040192681-A1 N-acylsulfonamide apoptosis promoters ABBVIE INC. 2004-09-30 US 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 (4 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 MTNR1A 2739/4885MTNR1B 2549/4885MAOA 3516/4885
US-20020055631-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 MTNR1A 2788/4885MTNR1B 2528/4885MAOA 3795/4885
US-20040192681-A1 N-acylsulfonamide apoptosis promoters BAX, BCLAF1, BCL2 MTNR1A 2739/4885MTNR1B 2549/4885MAOA 3516/4885
US-20090137585-A1 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS BAX, BCL2, BCOR MTNR1A 3261/4885MTNR1B 2789/4885MAOA 3476/4885

“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.