SCHEMBL8527293

SCHEMBL8527293

CCCCC(CC)C(O)C(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.46
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
HTR2A P28223 1/20 0.46
HRH1 P35367 1/20 0.46
KCNH2 Q12809 1/20 0.46
PRSS1 P07477 2/20 0.44
CTSG P08311 2/20 0.44
CTRB1 P17538 2/20 0.44
CMA1 P23946 2/20 0.44
CES2 O00748 4/20 0.44
CES1 P23141 4/20 0.44
SLC6A2 P23975 1/20 0.43
SLC6A3 Q01959 1/20 0.43
ELANE P08246 1/20 0.42
CTRC Q99895 1/20 0.42
CNR2 P34972 1/20 0.41
MAPK1 P28482 3/20 0.41
LMNA P02545 3/20 0.41
MAPT P10636 2/20 0.41

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
SCHEMBL11597057 0.95 CES2 (0.45) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL207880 0.93 CES2 (0.46) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL6582699 0.90 SLC6A2 (0.47) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL8531764 0.89 MMP2 (0.48) PRSS1CTSGCTRB1CMA1CES2
SCHEMBL6582853 0.89 MMP2 (0.48) PRSS1CTSGCTRB1CMA1CES2
SCHEMBL9155484 0.89 MMP2 (0.48) PRSS1CTSGCTRB1CMA1CES2
SCHEMBL7248385 0.87 PGR (0.41) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL9709534 0.81 PRSS1 (0.44) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL27635895 0.81 PRSS1 (0.44) PGRADRA2AADRA2BHTR2AHRH1
SCHEMBL11781795 0.80 CES2 (0.49) PGRADRA2AADRA2BHTR2AHRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0706510-B1 OXIMATION PROCESS HENKEL CORP (US) 1998-10-28 EP claimed
EP-0706510-A1 OXIMATION PROCESS HENKEL CORPORATION (US) 1996-04-17 EP claimed
EP-0706510-A4 OXIMATION PROCESS HENKEL CORP (US) 1996-02-19 EP claimed
US-5488161-A REACTION OF KETONE OR ALDEHYDE WITH HYDROXYLAMINE IN THE PRESENCE OF PHASE TRANSFER CATALYST, ALKYLPHENOL AND CARBOXY ACID OR BASE HENKEL CORPORATION (US) 1996-01-30 US claimed
WO-1995001957-A1 OXIMATION PROCESS HENKEL CORPORATION (US) 1995-01-19 WO claimed
EP-0706510-B1 OXIMATION PROCESS HENKEL CORP (US) 1998-10-28 EP disclosed
EP-0706510-A1 OXIMATION PROCESS HENKEL CORPORATION (US) 1996-04-17 EP disclosed
EP-0706510-A4 OXIMATION PROCESS HENKEL CORP (US) 1996-02-19 EP disclosed
US-5488161-A REACTION OF KETONE OR ALDEHYDE WITH HYDROXYLAMINE IN THE PRESENCE OF PHASE TRANSFER CATALYST, ALKYLPHENOL AND CARBOXY ACID OR BASE HENKEL CORPORATION (US) 1996-01-30 US disclosed
WO-1995001957-A1 OXIMATION PROCESS HENKEL CORPORATION (US) 1995-01-19 WO disclosed
WO-1993016204-A2 PROCESS AND APPARATUS FOR EXTRACTING SOLUTES FROM THEIR AQUEOUS SOLUTIONS COGNIS, INC. (US) 1993-08-19 WO disclosed