SCHEMBL13380348

SCHEMBL13380348

CCC(C)c1ccc(OC(C)C(=O)OC2C3CC4CC(C3)CC2C4)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
TSHR P16473 2/20 0.43
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 1/20 0.38
CTSV O60911 1/20 0.37
CTSL P07711 1/20 0.37
CTSS P25774 1/20 0.37
CTSK P43235 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
LMNA P02545 1/20 0.36
HSP90AA1 P07900 1/20 0.35
GAA P10253 1/20 0.34
SLC7A5 Q01650 1/20 0.34
LTB4R Q15722 1/20 0.34
LTB4R2 Q9NPC1 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
SCHEMBL13380344 0.83 ALDH1A1 (0.41) ALDH1A1TSHRKMT2AMEN1TDP1
SCHEMBL13380274 0.81 ALDH1A1 (0.56) ALDH1A1TSHRKMT2AMEN1TDP1
SCHEMBL13380342 0.79 ALDH1A1 (0.47) ALDH1A1TSHRKMT2AMEN1TDP1
SCHEMBL13380350 0.79 ALDH1A1 (0.41) ALDH1A1TSHRKMT2AMEN1TDP1
SCHEMBL14177779 0.78 ALDH1A1 (0.38) ALDH1A1TSHRKMT2AMEN1TDP1
SCHEMBL13380340 0.78 MEN1 (0.48) ALDH1A1TSHRKMT2AMEN1TDP1
SCHEMBL13380346 0.77 MEN1 (0.47) ALDH1A1TSHRKMT2AMEN1TDP1
SCHEMBL17175392 0.76 ALDH1A1 (0.37) ALDH1A1TSHRKMT2AMEN1TDP1
SCHEMBL17424296 0.76 ALDH1A1 (0.35) ALDH1A1TSHRKMT2AMEN1TDP1
SCHEMBL17175349 0.76 ALDH1A1 (0.48) ALDH1A1TSHRKMT2AMEN1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100081085-A1 Polymer and Resist Composition Comprising the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-04-01 US disclosed