SCHEMBL17465799

SCHEMBL17465799

CCOC(=O)C(C#N)c1ccncc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
KMT2A Q03164 3/20 0.58
MEN1 O00255 2/20 0.58
ESR2 Q92731 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NAMPT P43490 2/20 0.41
MAPK1 P28482 1/20 0.41
MAPT P10636 5/20 0.41
HTT P42858 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40
KDM4E B2RXH2 4/20 0.40
NPC1 O15118 1/20 0.39
NFKB1 P19838 1/20 0.39
STAT1 P42224 1/20 0.39
RAB9A P51151 1/20 0.39

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
SCHEMBL17466005 0.88 MEN1 (0.58) GAASMN1; SMN2KMT2AMEN1L3MBTL1
SCHEMBL502194 0.83 SMN1; SMN2 (0.61) GAASMN1; SMN2KMT2AMEN1L3MBTL1
SCHEMBL6289274 0.83 SMN1; SMN2 (0.54) GAASMN1; SMN2KMT2AMEN1L3MBTL1
SCHEMBL27920341 0.82 SMN1; SMN2 (0.60) GAASMN1; SMN2KMT2AMEN1L3MBTL1
SCHEMBL13516527 0.82 GAA (0.57) GAASMN1; SMN2KMT2AMEN1L3MBTL1
SCHEMBL28518363 0.81 MEN1 (0.52) GAASMN1; SMN2KMT2AMEN1HSD17B10
SCHEMBL5081149 0.81 SMN1; SMN2 (0.51) GAASMN1; SMN2KMT2AMEN1L3MBTL1
SCHEMBL360667 0.81 SMN1; SMN2 (0.51) GAASMN1; SMN2KMT2AMEN1MAPT
SCHEMBL13700788 0.81 KMT2A (0.51) GAASMN1; SMN2KMT2AMEN1HSD17B10
SCHEMBL30771326 0.81 SMN1; SMN2 (0.51) GAASMN1; SMN2KMT2AMEN1HSD17B10

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-3172272-B1 MODIFIED HETEROPHASIC POLYOLEFIN COMPOSITION MILLIKEN & CO (US) 2020-11-25 EP disclosed
WO-2016014122-A1 MODIFIED HETEROPHASIC POLYOLEFIN COMPOSITION MILLIKEN & COMPANY (US) 2016-01-28 WO disclosed
CN-103483244-A Preparation method of 2-(pyridine-4-yl) acetonitrile WYLTON JINGLIN ELECTRONIC MATERIAL CO LTD 2014-01-01 CN disclosed