SCHEMBL5202946

SCHEMBL5202946

CCCCOC(=O)C(CC)OCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.50
ATM Q13315 1/20 0.47
TSHR P16473 6/20 0.44
HPGD P15428 1/20 0.44
LMNA P02545 2/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
ESR1 P03372 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPK1 P28482 1/20 0.42
NR1H2 P55055 1/20 0.42
RNASEL Q05823 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HCAR2 Q8TDS4 1/20 0.41
NAAA Q02083 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
PDE4D Q08499 1/20 0.41
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL13415661 0.94 ALDH1A1 (0.43) ALDH1A1ATMTSHRHPGDLMNA
SCHEMBL29119116 0.92 NAAA (0.52) ALDH1A1TSHRLMNAHCAR2NAAA
SCHEMBL9632816 0.92 NAAA (0.52) ALDH1A1TSHRLMNAHCAR2NAAA
SCHEMBL27375764 0.90 ALDH1A1 (0.48) ALDH1A1ATMTSHRHPGDLMNA
SCHEMBL7616354 0.90 ALDH1A1 (0.43) ALDH1A1ATMTSHRHPGDLMNA
SCHEMBL5199730 0.86 ALDH1A1 (0.48) ALDH1A1ATMTSHRHPGDLMNA
SCHEMBL5201584 0.86 ALDH1A1 (0.48) ALDH1A1ATMTSHRHPGDLMNA
SCHEMBL29119244 0.84 FAAH (0.45) ALDH1A1TSHRESR1HCAR2NAAA
SCHEMBL29119213 0.84 FAAH (0.45) ALDH1A1TSHRESR1HCAR2NAAA
SCHEMBL29119361 0.84 FAAH (0.45) ALDH1A1TSHRESR1HCAR2NAAA

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-1778804-A1 SINGLE-COMPONENT SYSTEM BASED ON CO-REACTIVE LATEX, PREPARATION METHOD AND USE IN THE FIELD OF FORMOL-FREE COATINGS Arkema France (FR) 2007-05-02 EP claimed
WO-2006010804-A1 SINGLE-COMPONENT SYSTEM BASED ON CO-REACTIVE LATEX, PREPARATION METHOD AND USE IN THE FIELD OF FORMOL-FREE COATINGS ARKEMA FRANCE (FR) 2006-02-02 WO claimed
CN-1269585-A Conductive paste TOYO BOSEKI (JP) 2000-10-11 CN disclosed