SCHEMBL11040574

SCHEMBL11040574

COC(OC)OC(O)(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.51
SRC P12931 1/20 0.47
KCNN4 O15554 1/20 0.40
TSHR P16473 2/20 0.39
CES2 O00748 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 2/20 0.34
MAPT P10636 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
ACHE P22303 1/20 0.34
MAPK1 P28482 2/20 0.34
HTT P42858 1/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33

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
SCHEMBL2818433 0.83 CES1 (0.50) CES1SRCKCNN4TSHRKMT2A
SCHEMBL277653 0.81 CES1 (0.65) CES1SRCKCNN4TSHRCES2
SCHEMBL11896594 0.80 CES1 (0.46) CES1SRCKCNN4TSHRCES2
Methoxymethane SCHEMBL36163 0.80 CES1 (0.62) CES1SRCKCNN4TSHRCES2
SCHEMBL5133540 0.78 CES1 (0.45) CES1SRCKCNN4KMT2AALDH1A1
SCHEMBL11101775 0.77 CES1 (0.53) CES1SRCKCNN4TSHRCES2
SCHEMBL621110 0.75 CES1 (0.52) CES1SRCKCNN4TSHRCES2
SCHEMBL11072129 0.75 CES1 (0.53) CES1SRCKCNN4TSHRCES2
SCHEMBL173918 0.75 CES1 (0.51) CES1SRCKCNN4TSHRCES2
SCHEMBL2814807 0.75 CES1 (0.51) CES1SRCKCNN4TSHRKMT2A

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-0057162-B1 PROCESS FOR THE PRODUCTION OF IMAGES CIBA-GEIGY AG (CH) 1984-06-27 EP disclosed
US-4368253-A Image formation process CIBA-GEIGY CORPORATION (US) 1983-01-11 US disclosed
EP-0057162-A1 Process for the production of images CIBA-GEIGY AG (CH) 1982-08-04 EP disclosed