SCHEMBL7755273

SCHEMBL7755273

O=C(CO)OCCCCCCCCOC(=O)CO.O=C(CO)OCCCCCCCCOC(=O)CO.[Ti]

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.50
TSHR P16473 3/20 0.42
ALDH1A1 P00352 1/20 0.42
CYP3A4 P08684 1/20 0.42
RAD52 P43351 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
FAAH O00519 1/20 0.41
HTR2C P28335 1/20 0.39
DGKA P23743 1/20 0.39
ADRA2A P08913 1/20 0.37
ADRA1A P35348 1/20 0.37
EPHX1 P07099 1/20 0.37
HTT P42858 1/20 0.36
MAPT P10636 1/20 0.36
BLM P54132 1/20 0.36
ACHE P22303 4/20 0.35

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
SCHEMBL423033 0.97 NAAA (0.52) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL31092629 0.97 NAAA (0.52) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL5696754 0.97 NAAA (0.52) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL11651701 0.94 NAAA (0.48) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL29090831 0.93 NAAA (0.45) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL29040267 0.90 NAAA (0.46) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL27942783 0.90 NAAA (0.46) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL2220463 0.89 NAAA (0.69) NAAATSHRALDH1A1RAD52NPSR1
SCHEMBL27145454 0.88 NAAA (0.42) NAAATSHRALDH1A1CYP3A4RAD52
SCHEMBL9841033 0.86 NAAA (0.41) NAAATSHRALDH1A1CYP3A4RAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0772090-B1 Electrophotographic photoreceptor and electrophotographic image forming method KONISHIROKU PHOTO IND (JP) 2001-04-11 EP disclosed
EP-0772090-A1 Electrophotographic photoreceptor and electrophotographic image forming method KONICA CORPORATION (JP) 1997-05-07 EP disclosed