SCHEMBL8102667

SCHEMBL8102667

CSC1CC(=O)N1CC(=O)NOCCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.41
USP2 O75604 1/20 0.37
SIGMAR1 Q99720 1/20 0.36
POLB P06746 2/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 4/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PKM P14618 1/20 0.35
NPSR1 Q6W5P4 1/20 0.34
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 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
SCHEMBL8104198 0.88 NPC1 (0.42) EPHX2SIGMAR1
SCHEMBL8104174 0.80 EPHX2 (0.39) EPHX2USP2SIGMAR1POLBLMNA
SCHEMBL8439553 0.80 NAAA (0.39) EPHX2ALDH1A1SMN1; SMN2
SCHEMBL8094756 0.80 HTT (0.51) USP2POLBLMNASMN1; SMN2
SCHEMBL8094757 0.80 HTT (0.51) USP2POLBLMNASMN1; SMN2
SCHEMBL8102648 0.80 HTT (0.51) USP2POLBLMNASMN1; SMN2
SCHEMBL8102640 0.79 TRPV1 (0.51) EPHX2POLBLMNAL3MBTL1ALDH1A1
SCHEMBL8094868 0.78 HMOX1 (0.42) SIGMAR1L3MBTL1ALDH1A1
SCHEMBL8104160 0.76 HDAC3 (0.42) EPHX2LMNASMN1; SMN2
SCHEMBL11106025 0.75 ALDH1A1 (0.44) L3MBTL1ALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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