SCHEMBL4150898

SCHEMBL4150898

C=CC(=O)Oc1ccc(C(C)C(=O)OC(C)(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.44
APP P05067 1/20 0.42
PTGS2 P35354 2/20 0.40
ELANE P08246 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.38
TDP1 Q9NUW8 1/20 0.38
ATM Q13315 1/20 0.35
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
TSHR P16473 1/20 0.34
PTGS1 P23219 1/20 0.34
AKR1C3 P42330 1/20 0.34
AKR1C2 P52895 1/20 0.34
CDC42 P60953 1/20 0.34
RAC1 P63000 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
SCHEMBL6783979 0.80 APP (0.45) APPPTGS2TDP1KDM4EMAPT
SCHEMBL4143696 0.78 ELANE (0.64) THRBELANE
SCHEMBL26943657 0.77 THRB (0.54) THRBPTGS2ELANEMAPTHPGD
SCHEMBL4596363 0.77 THRB (0.54) THRBELANEKDM4EMAPTHPGD
SCHEMBL5215244 0.76 APP (0.49) APPTDP1AKR1C3AKR1C2
SCHEMBL8850119 0.76 APP (0.49) APPGAAMAPT
SCHEMBL2065202 0.75 TYR (0.48) APPKDM4EAKR1C3AKR1C2
SCHEMBL4151935 0.75 ELANE (0.51) THRBELANEL3MBTL1TDP1MAPT
SCHEMBL18966025 0.75 THRB (0.40) THRBPTGS2L3MBTL1TDP1
SCHEMBL1825479 0.75 CXCR2 (0.47) APPPTGS2ELANEL3MBTL1TDP1

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-20090130419-A1 FOAM SHEET AND PRODUCTION PROCESS THEREOF OJI PAPER CO., LTD (JP) 2009-05-21 US disclosed