SCHEMBL2035268

SCHEMBL2035268

CCN(CC(C#N)C(=O)OC)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.42
▸ MEN1 O00255 5/20 0.42
▸ NOX1 Q9Y5S8 2/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ CNR2 P34972 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ NPY1R P25929 1/20 0.40
▸ NPY2R P49146 1/20 0.40
▸ ANPEP P15144 2/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ TSHR P16473 2/20 0.38
▸ GLA P06280 1/20 0.38
▸ LTA4H P09960 1/20 0.38
▸ GAA P10253 1/20 0.37
▸ HTT P42858 1/20 0.37

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
SCHEMBL12639955 0.78 LTA4H (0.51) KMT2AMEN1NOX1NPC1RAB9A
SCHEMBL12961529 0.78 LTA4H (0.51) KMT2AMEN1NOX1NPC1RAB9A
SCHEMBL2035271 0.75 MEN1 (0.40) KMT2AMEN1NOX1NPC1RAB9A
SCHEMBL28681719 0.74 TSHR (0.48) KMT2AMEN1NOX1NPC1RAB9A
SCHEMBL10523997 0.73 ANPEP (0.57) KMT2AMEN1NPC1RAB9AANPEP
SCHEMBL11704962 0.72 TSHR (0.47) KMT2AMEN1NOX1NPC1RAB9A
SCHEMBL4837691 0.71 CTSC (0.49) KMT2AMEN1CNR2MAPTANPEP
SCHEMBL1278800 0.71 KMT2A (0.64) KMT2AMEN1NPC1RAB9AMAPT
SCHEMBL10409302 0.71 LMNA (0.47) KMT2AMEN1NOX1NPC1RAB9A
SCHEMBL11317372 0.70 MEN1 (0.43) KMT2AMEN1NOX1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2516728-B1 DISPERSE DYES COLOURTEX INDUSTRIES LTD (IN) 2020-05-27 — — EP disclosed
US-8506652-B2 Disperse dyes COLOURTEX INDUSTRIES LIMITED (IN) 2013-08-13 — — US disclosed
US-20130117947-A1 DISPERSE DYES COLOURTEX INDUSTRIES LIMITED (IN) 2013-05-16 — — US disclosed
EP-2516728-A2 DISPERSE DYES Colourtex Industries Limited (IN) 2012-10-31 — — EP disclosed
WO-2011077462-A2 DISPERSE DYES COLOURTEX INDUSTRIES LIMITED (IN) 2011-06-30 — — WO disclosed
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