SCHEMBL6988062

SCHEMBL6988062

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.44
MAOB P27338 1/20 0.44
MTNR1A P48039 3/20 0.43
MTNR1B P49286 3/20 0.43
MMP13 P45452 1/20 0.42
PPARG P37231 3/20 0.42
PPARA Q07869 3/20 0.42
CTSS P25774 4/20 0.41
CTSK P43235 3/20 0.41
ATM Q13315 1/20 0.41
PPARD Q03181 2/20 0.40
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
KIF11 P52732 2/20 0.40
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA7 P43166 1/20 0.39
CA14 Q9ULX7 1/20 0.39
MALT1 Q9UDY8 1/20 0.38
IDO1 P14902 1/20 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
SCHEMBL2945260 1.00 MAOA (0.44) MAOAMAOBMTNR1AMTNR1BMMP13
SCHEMBL7749265 0.82 KIF11 (0.59) KIF11
Hydrochloric Acid SCHEMBL4671067 0.81 MAOA (0.46) MAOAMAOBMTNR1AMTNR1BKIF11
Hydrochloric Acid SCHEMBL4671065 0.81 MAOA (0.46) MAOAMAOBMTNR1AMTNR1BKIF11
SCHEMBL4420857 0.81 ATM (0.55) CTSSCTSKATMCTSLCTSB
SCHEMBL2945955 0.78 ATM (0.50) MTNR1AMTNR1BMMP13PPARGPPARA
SCHEMBL31450859 0.78 MALT1 (0.46) MAOAMAOBMTNR1AMTNR1BPPARG
SCHEMBL9404273 0.78 MTNR1A (0.64) MTNR1AMTNR1BMMP13PPARGPPARA
SCHEMBL8910228 0.78 MTNR1A (0.64) MTNR1AMTNR1BMMP13PPARGPPARA
SCHEMBL6988063 0.77 PPARA (0.52) MTNR1AMTNR1BMMP13PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1318978-A2 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS Abbott Laboratories (US) 2003-06-18 EP disclosed
WO-2002024636-A2 N-ACYLSULFONAMIDE APOPTOSIS PROMOTERS ABBOTT LABORATORIES (US) 2002-03-28 WO disclosed
US-5258362-A Enzyme inhibitors, amides with oxetane ring ABBOTT LABORATORIES (US) 1993-11-02 US disclosed