SCHEMBL7385153

SCHEMBL7385153

O=C1CC(Cc2ccccc2)N1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.47
CREBBP Q92793 2/20 0.47
DDB1 Q16531 1/20 0.47
CRBN Q96SW2 1/20 0.47
BRD4 O60885 1/20 0.47
POLB P06746 1/20 0.47
ITGB3 P05106 1/20 0.45
ITGB2 P05107 1/20 0.45
ITGB1 P05556 1/20 0.45
ITGAV P06756 1/20 0.45
ITGA2B P08514 1/20 0.45
ITGA5 P08648 1/20 0.45
ITGB5 P18084 1/20 0.45
ITGAL P20701 1/20 0.45
GBA1 P04062 1/20 0.42

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
SCHEMBL7385157 1.00 HDAC8 (0.47) HDAC8CREBBPDDB1CRBNBRD4
SCHEMBL24491239 0.85 TACR2 (0.46) HDAC8
SCHEMBL3220126 0.83 HDAC8 (0.41) HDAC8DDB1CRBNPOLB
SCHEMBL8270781 0.79 CTSD (0.59) HDAC8DDB1CRBNPOLBGBA1
SCHEMBL2132646 0.79 CTSD (0.59) HDAC8DDB1CRBNPOLBGBA1
SCHEMBL19419777 0.79 CTSD (0.59) HDAC8DDB1CRBNPOLBGBA1
SCHEMBL14646624 0.78 POLB (0.51) HDAC8DDB1CRBNPOLBGBA1
SCHEMBL14646638 0.78 POLB (0.51) HDAC8DDB1CRBNPOLBGBA1
SCHEMBL4989773 0.77 MEN1 (0.47) CREBBPBRD4
SCHEMBL877508 0.76 HDAC6 (0.48) HDAC8DDB1CRBNPOLB

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-5338861-A Cleaving lactam N-carboxylate or lactim O-carboxylate with elimination of carbon dioxide by heating in gas or liquid phase BAYER AKTIENGESELLSCHAFT (DE) 1994-08-16 US claimed
EP-1021405-B1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF HCMV INFECTIONS BOEHRINGER INGELHEIM CA LTD (CA) 2002-09-25 EP disclosed
US-6242439-B1 Azetidinone derivatives for the treatment of HCMV infections BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2001-06-05 US disclosed
EP-1021405-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF HCMV INFECTIONS BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 2000-07-26 EP disclosed
WO-1999018072-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF HCMV INFECTIONS BOEHRINGER INGELHEIM (CANADA) LTD. (CA) 1999-04-15 WO disclosed
EP-0531673-B1 Process for the preparation of N-substituted lactams BAYER AG (DE) 1996-09-11 EP disclosed
US-5338861-A Cleaving lactam N-carboxylate or lactim O-carboxylate with elimination of carbon dioxide by heating in gas or liquid phase BAYER AKTIENGESELLSCHAFT (DE) 1994-08-16 US disclosed
EP-0531673-A1 Process for the preparation of N-substituted lactams BAYER AG (DE) 1993-03-17 EP disclosed