SCHEMBL3700318

SCHEMBL3700318

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

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
CYP2C19 P33261 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 2/20 0.38
GBA1 P04062 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
POLB P06746 2/20 0.35
KDM4E B2RXH2 1/20 0.35
BRD4 O60885 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
RECQL P46063 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
SCHEMBL2719198 0.94 ALDH1A1 (0.45) L3MBTL1CYP2C19MEN1KMT2AALDH1A1
SCHEMBL3669603 0.94 ALDH1A1 (0.45) L3MBTL1CYP2C19MEN1KMT2AALDH1A1
SCHEMBL27937533 0.88 L3MBTL1 (0.47) L3MBTL1CYP2C19MEN1KMT2AALDH1A1
SCHEMBL7768685 0.87 SMN1; SMN2 (0.37) ALDH1A1SMN1; SMN2POLBBRD4
SCHEMBL688298 0.87 MGLL (0.42) L3MBTL1CYP2C19KMT2AALDH1A1GBA1
SCHEMBL793281 0.85 L3MBTL1 (0.48) L3MBTL1CYP2C19MEN1KMT2AALDH1A1
SCHEMBL2709981 0.81 CYP3A4 (0.37) L3MBTL1CYP2C19KMT2AALDH1A1SMN1; SMN2
SCHEMBL7275276 0.79 DPP4 (0.48) L3MBTL1MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6613370 0.78 L3MBTL1 (0.40) L3MBTL1MEN1KMT2AALDH1A1MAPK1
SCHEMBL688493 0.77 POLB (0.60) CYP2C19MEN1KMT2AALDH1A1POLB

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-2318568-B1 CORROSION INHIBITORS HAVING INCREASED BIOLOGICAL DEGRADABILITY AND MINIMIZED TOXICITY CLARIANT FINANCE BVI LTD (VG) 2012-05-16 EP disclosed
WO-2012024042-A3 CLOSURE ASSEMBLIES FOR MOVABLE PARTITIONS, MOVABLE PARTITION SYSTEMS INCLUDING CLOSURE ASSEMBLIES AND RELATED METHODS WON-DOOR CORPORATION (US) 2012-05-10 WO disclosed
EP-2242872-B1 CORROSION INHIBITORS HAVING INCREASED BIOLOGICAL DEGRADABILITY AND MINIMIZED TOXICITY CLARIANT FINANCE BVI LTD (VG) 2011-12-07 EP disclosed