SCHEMBL7775502

SCHEMBL7775502

CCCCCCCCCC(=O)Oc1ccc(OC(=O)c2ccccc2-c2ccc(OC(C)CCCCCC)cc2)c(F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
ALOX15 P16050 1/20 0.39
PTPN11 Q06124 1/20 0.39
POLM Q9NP87 2/20 0.37
POLK Q9UBT6 2/20 0.37
POLL Q9UGP5 2/20 0.37
POLH Q9Y253 2/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
KDM4E B2RXH2 1/20 0.37
RECQL P46063 1/20 0.37
PPARA Q07869 2/20 0.36
PPARG P37231 1/20 0.36
GPR88 Q9GZN0 1/20 0.35
MAPK1 P28482 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
LTB4R2 Q9NPC1 3/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
PRKCG P05129 1/20 0.34

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
SCHEMBL7776817 0.97 ALDH1A1 (0.39) ALDH1A1ALOX15PTPN11POLMPOLK
SCHEMBL7777002 0.88 ALDH1A1 (0.45) ALDH1A1PTPN11POLMPOLKPOLL
SCHEMBL7773650 0.88 ALDH1A1 (0.45) ALDH1A1PTPN11POLMPOLKPOLL
SCHEMBL7776180 0.88 ALDH1A1 (0.45) ALDH1A1PTPN11POLMPOLKPOLL
SCHEMBL7773810 0.88 ALDH1A1 (0.45) ALDH1A1PTPN11POLMPOLKPOLL
SCHEMBL7774571 0.88 ALDH1A1 (0.45) ALDH1A1PTPN11POLMPOLKPOLL
SCHEMBL7775496 0.88 ALDH1A1 (0.45) ALDH1A1PTPN11POLMPOLKPOLL
SCHEMBL7769396 0.88 ALDH1A1 (0.45) ALDH1A1PTPN11POLMPOLKPOLL
SCHEMBL7769909 0.87 ALDH1A1 (0.41) ALDH1A1PTPN11POLMPOLKPOLL
SCHEMBL7776131 0.87 ALDH1A1 (0.41) ALDH1A1PTPN11POLMPOLKPOLL

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-0844294-B1 Racemic compound and anti-ferroelectric liquid crystal composition containing the compound MITSUBISHI GAS CHEMICAL CO (JP) 2001-08-16 EP disclosed
US-5985172-A LARGE-SIZED LIQUID CRYSTAL DISPLAY DEVICE OF HIGHER PERFORMANCE THAT HAS A HIGHER DISPLAY CAPACITY AND A HIGHER DISPLAY QUALITY MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1999-11-16 US disclosed
EP-0844294-A1 Racemic compound and anti-ferroelectric liquid crystal composition containing the compound MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1998-05-27 EP disclosed