SCHEMBL3818013

SCHEMBL3818013

O=C(CC(O)O)N1CCOCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.55
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
TSHR P16473 2/20 0.50
ALOX15 P16050 1/20 0.50
HSD17B10 Q99714 1/20 0.50
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
FKBP1A P62942 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
POLB P06746 2/20 0.46
GAA P10253 1/20 0.46
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA9 Q16790 1/20 0.45
LMNA P02545 2/20 0.44
GLA P06280 1/20 0.44
DCTPP1 Q9H773 1/20 0.44
TP53 P04637 2/20 0.44
MAPK1 P28482 1/20 0.44

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
SCHEMBL8484573 0.83 L3MBTL1 (0.52) L3MBTL1MEN1KMT2ATSHRALOX15
SCHEMBL294992 0.81 POLB (0.55) L3MBTL1MEN1KMT2ATSHRALOX15
SCHEMBL4186785 0.80 L3MBTL1 (0.48) L3MBTL1MEN1KMT2ATSHRALOX15
SCHEMBL4186778 0.80 L3MBTL1 (0.48) L3MBTL1MEN1KMT2ATSHRALOX15
SCHEMBL8488474 0.80 L3MBTL1 (0.48) L3MBTL1MEN1KMT2ATSHRALOX15
SCHEMBL8484571 0.79 L3MBTL1 (0.52) L3MBTL1MEN1KMT2ATSHRALOX15
SCHEMBL19261358 0.78 MEN1 (0.50) L3MBTL1MEN1KMT2ATSHRALOX15
SCHEMBL22651305 0.78 L3MBTL1 (0.50) L3MBTL1MEN1KMT2ATSHRALOX15
SCHEMBL3988865 0.78 L3MBTL1 (0.50) L3MBTL1MEN1KMT2ATSHRALOX15
SCHEMBL9111586 0.78 L3MBTL1 (0.50) L3MBTL1MEN1KMT2ATSHRALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513802-B1 ALPHA-SULFONYLAMINO-ACETONITRILES SYNGENTA PARTICIPATIONS AG (CH) 2009-08-19 EP claimed