SCHEMBL1123429

SCHEMBL1123429

CCCCCCCCCCC(CCCCCCCCN=C=O)C(CCCCCCCCCC)CCCCCCCCN=C=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.47
MAPT P10636 1/20 0.38
GPR84 Q9NQS5 7/20 0.37
FDPS P14324 3/20 0.35
FFAR1 O14842 1/20 0.35
LMNA P02545 1/20 0.34
LCK P06239 1/20 0.34
PPARD Q03181 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
ADH1B P00325 1/20 0.33
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH4 P08319 1/20 0.33
ADH7 P40394 1/20 0.33
LAP3 P28838 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
DNM1 Q05193 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
SCHEMBL13069624 1.00 NAAA (0.47) NAAAMAPTGPR84FDPSFFAR1
SCHEMBL9975650 1.00 NAAA (0.47) NAAAMAPTGPR84FDPSFFAR1
SCHEMBL13105852 0.91 NAAA (0.40) NAAAMAPTGPR84FDPSFFAR1
SCHEMBL9975653 0.90 TSHR (0.41) NAAAMAPTGPR84FDPSFFAR1
SCHEMBL11321426 0.88 NAAA (0.47) NAAAMAPTGPR84FDPSFFAR1
SCHEMBL527174 0.87 NAAA (0.58) NAAAGPR84LMNAPPARDMEN1
SCHEMBL37419 0.87 NAAA (0.58) NAAAGPR84LMNAPPARDMEN1
SCHEMBL10791564 0.87 NAAA (0.58) NAAAGPR84LMNAPPARDMEN1
SCHEMBL15486455 0.87 NAAA (0.58) NAAAGPR84LMNAPPARDMEN1
SCHEMBL5575642 0.87 NAAA (0.58) NAAAGPR84LMNAPPARDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1985672-B1 Phase Change Ink Compositions XEROX CORP (US) 2011-02-09 EP disclosed
EP-1985672-B1 Phase Change Ink Compositions XEROX CORP (US) 2011-02-09 EP disclosed
US-7811370-B2 Phase change ink compositions XEROX CORPORATION (US) 2010-10-12 US disclosed
US-7811370-B2 Phase change ink compositions XEROX CORPORATION (US) 2010-10-12 US disclosed
US-7811370-B2 Phase change ink compositions XEROX CORPORATION (US) 2010-10-12 US disclosed
US-20080264288-A1 Phase change ink compositions XEROX CORPORATION. 2008-10-30 US disclosed
US-20080264288-A1 Phase change ink compositions XEROX CORPORATION. 2008-10-30 US disclosed
US-20080264288-A1 Phase change ink compositions XEROX CORPORATION. 2008-10-30 US disclosed
EP-1985672-A1 Phase Change Ink Compositions Xerox Corporation (US) 2008-10-29 EP disclosed
EP-1985672-A1 Phase Change Ink Compositions Xerox Corporation (US) 2008-10-29 EP disclosed