SCHEMBL793281

SCHEMBL793281

CCCCN1CC(OC(=O)OC)CC1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.48
CYP2C19 P33261 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
BRD4 O60885 2/20 0.39
ALDH1A1 P00352 1/20 0.36
POLB P06746 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
RECQL P46063 1/20 0.35
GBA1 P04062 1/20 0.35
OGA O60502 1/20 0.35
HPGD P15428 1/20 0.34
BACE1 P56817 1/20 0.34
BACE2 Q9Y5Z0 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33

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
SCHEMBL27937533 0.85 L3MBTL1 (0.47) L3MBTL1CYP2C19MEN1KMT2ABRD4
SCHEMBL3700318 0.85 L3MBTL1 (0.47) L3MBTL1CYP2C19MEN1KMT2ABRD4
SCHEMBL3669603 0.80 ALDH1A1 (0.45) L3MBTL1CYP2C19MEN1KMT2AALDH1A1
SCHEMBL2719198 0.80 ALDH1A1 (0.45) L3MBTL1CYP2C19MEN1KMT2AALDH1A1
SCHEMBL798077 0.79 POLB (0.55) CYP2C19MEN1KMT2ABRD4ALDH1A1
SCHEMBL8750297 0.77 BRD4 (0.33) MEN1KMT2ABRD4ALDH1A1POLB
SCHEMBL793001 0.77 BRD4 (0.54) MEN1KMT2ABRD4CYP1A2SMN1; SMN2
SCHEMBL3133394 0.77 BRD4 (0.64) L3MBTL1CYP2C19MEN1KMT2ABRD4
SCHEMBL12667390 0.77 BRD4 (0.64) L3MBTL1CYP2C19MEN1KMT2ABRD4
SCHEMBL3840857 0.76 MEN1 (0.39) L3MBTL1CYP2C19MEN1KMT2AALDH1A1

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-2615911-A1 PESTICIDE PREPARATIONS CONTAINING N-SUBSTITUTED 2-PYRROLIDONE-4-CARBONIC ACID ESTERS Clariant Finance (BVI) Limited (VG) 2013-07-24 EP disclosed
EP-2616438-A1 USE OF N-SUBSTITUTED 2-PYRROLIDONE-4-CARBONIC ACID ESTERS AS SOLVENTS Clariant Finance (BV) Limited (VG) 2013-07-24 EP disclosed
WO-2012034689-A1 PESTICIDE PREPARATIONS CONTAINING N-SUBSTITUTED 2-PYRROLIDONE-4-CARBONIC ACID ESTERS CLARIANT INTERNATIONAL LTD (CH) 2012-03-22 WO disclosed
WO-2012034688-A1 USE OF N-SUBSTITUTED 2-PYRROLIDONE-4-CARBONIC ACID ESTERS AS SOLVENTS CLARIANT INTERNATIONAL LTD (CH) 2012-03-22 WO disclosed