SCHEMBL8094843

SCHEMBL8094843

CS(=O)(=O)C1CC(=O)N1Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 1/20 0.45
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
HCRTR1 O43613 1/20 0.42
HCRTR2 O43614 1/20 0.42
HPGD P15428 1/20 0.42
TSHR P16473 1/20 0.42
ALDH1A1 P00352 4/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL8104154 0.81 FAAH (0.44) MEN1KMT2ATSHRPOLB
SCHEMBL8104137 0.78 POLB (0.43) ALDH1A1POLB
SCHEMBL11065133 0.77 HCRTR1 (0.42) EHMT2MEN1KMT2AHCRTR1HCRTR2
SCHEMBL8104235 0.77 HTT (0.50) MEN1KMT2ASMN1; SMN2HPGDTSHR
SCHEMBL21538655 0.76 LMNA (0.50) EHMT2MEN1KMT2AHCRTR1HCRTR2
SCHEMBL8104135 0.76 GSK3A (0.42) MEN1KMT2ASMN1; SMN2HPGDALDH1A1
SCHEMBL8110081 0.76 HDAC3 (0.41) MEN1KMT2ASMN1; SMN2POLB
SCHEMBL21538635 0.75 ALDH1A1 (0.50) EHMT2MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL8110094 0.74 MAPT (0.43)
SCHEMBL8104121 0.74 MAPT (0.43)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6071899-A Azetidinone derivatives for the treatment of atherosclerosis SMITHKLINE BEECHAM P.L.C. (GB) 2000-06-06 US claimed
EP-0788478-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1997-08-13 EP claimed
WO-1996013484-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1996-05-09 WO claimed
US-6071899-A Azetidinone derivatives for the treatment of atherosclerosis SMITHKLINE BEECHAM P.L.C. (GB) 2000-06-06 US disclosed
EP-0788478-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1997-08-13 EP disclosed