SCHEMBL2158060

SCHEMBL2158060

CCC(C)CCCCc1ccccc1C(=C(C#N)C(=O)O)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
LMNA P02545 2/20 0.45
MAPK1 P28482 2/20 0.45
SLC16A3 O15427 4/20 0.34
CYSLTR2 Q9NS75 2/20 0.33
CYSLTR1 Q9Y271 2/20 0.33
MAPT P10636 2/20 0.33
XBP1 P17861 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
DHODH Q02127 1/20 0.32
CTSC P53634 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
CA2 P00918 1/20 0.30
CYP3A4 P08684 1/20 0.30

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
SCHEMBL15861897 0.89 ALDH1A1 (0.42) ALDH1A1LMNAMAPK1SLC16A3CYSLTR2
SCHEMBL15324514 0.85 ALDH1A1 (0.46) ALDH1A1LMNAMAPK1CYSLTR2CYSLTR1
SCHEMBL8370214 0.85 ALDH1A1 (0.46) ALDH1A1LMNAMAPK1CYSLTR2CYSLTR1
SCHEMBL9069619 0.82 ALDH1A1 (0.63) ALDH1A1LMNAMAPK1MAPTXBP1
SCHEMBL228932 0.80 ALDH1A1 (0.44) ALDH1A1LMNAMAPK1MAPTXBP1
SCHEMBL3677822 0.78 PTPN1 (0.41) ALDH1A1LMNAMAPK1MAPTXBP1
SCHEMBL125996 0.78 ALDH1A1 (0.61) ALDH1A1LMNAMAPK1MAPTXBP1
SCHEMBL343182 0.76 ALDH1A1 (0.43) ALDH1A1LMNAMAPK1CYSLTR2CYSLTR1
SCHEMBL30712327 0.74 ALDH1A1 (0.43) ALDH1A1LMNAMAPK1CYSLTR2CYSLTR1
SCHEMBL475422 0.74 ALDH1A1 (0.43) ALDH1A1LMNAMAPK1CYSLTR2CYSLTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110182072-A1 PHOSPHOR, PRODUCTION METHOD OF PHOSPHOR, PHOSPHOR-CONTAINING COMPOSITION, AND LIGHT EMITTING DEVICE MITSUBISHI CHEMICAL CORPORATION (JP) 2011-07-28 US disclosed
EP-2175007-A1 PHOSPHOR, METHOD FOR PRODUCING PHOSPHOR, PHOSPHOR-CONTAINING COMPOSITION, AND LIGHT-EMITTING DEVICE Mitsubishi Chemical Corporation (JP) 2010-04-14 EP disclosed
US-20060132011-A1 Light emitting device MITSUBISHI CHEMICAL CORPORATION (JP) 2006-06-22 US disclosed
EP-1641048-A1 LIGHT-EMITTING DEVICE Mitsubishi Chemical Corporation (JP) 2006-03-29 EP disclosed