SCHEMBL10788834

SCHEMBL10788834

CCCCCCCCCCC=C(C(=O)OCC)C(=O)OCC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.60
FAAH O00519 2/20 0.57
NPSR1 Q6W5P4 2/20 0.47
GLO1 Q04760 1/20 0.47
ALDH1A1 P00352 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CYP2D6 P10635 1/20 0.46
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
CYP2C19 P33261 2/20 0.40
TERT O14746 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP3A4 P08684 1/20 0.40
HPGD P15428 1/20 0.40
GMNN O75496 1/20 0.40
USP2 O75604 1/20 0.40
CYP1A2 P05177 1/20 0.40
POLB P06746 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
SCHEMBL20771517 1.00 EP300 (0.60) EP300FAAHNPSR1GLO1ALDH1A1
SCHEMBL11439397 1.00 EP300 (0.60) EP300FAAHNPSR1GLO1ALDH1A1
SCHEMBL4920336 1.00 EP300 (0.60) EP300FAAHNPSR1GLO1ALDH1A1
SCHEMBL4914440 1.00 EP300 (0.60) EP300FAAHNPSR1GLO1ALDH1A1
SCHEMBL6067678 0.98 EP300 (0.57) EP300FAAHNPSR1GLO1ALDH1A1
SCHEMBL13269486 0.94 EP300 (0.57) EP300FAAHNPSR1GLO1ALDH1A1
SCHEMBL6067615 0.92 NPSR1 (0.50) EP300FAAHNPSR1GLO1ALDH1A1
SCHEMBL12693568 0.91 GLO1 (0.56) EP300FAAHNPSR1GLO1ALDH1A1
SCHEMBL11717792 0.91 GLO1 (0.56) EP300FAAHNPSR1GLO1ALDH1A1
SCHEMBL4926110 0.91 GLO1 (0.56) EP300FAAHNPSR1GLO1ALDH1A1

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-0097719-B1 PROCESS FOR PRODUCING HIGHER DIBASIC ACID DIMETHYL ESTER Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1987-06-03 EP disclosed
US-4525251-A DIMETHYL SEBACATE, BRASSYLATE, OR THAPSATE; BATCH ELECTROLYTIC CON ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-06-25 US disclosed
EP-0097719-A1 PROCESS FOR PRODUCING HIGHER DIBASIC ACID DIMETHYL ESTER Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-01-11 EP disclosed