SCHEMBL12482425

SCHEMBL12482425

CCCCCCCC(C)C(O)C(=NO)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.41
CES2 O00748 2/20 0.39
CES1 P23141 2/20 0.39
ALDH1A1 P00352 2/20 0.38
ASAH1 Q13510 1/20 0.38
ACER2 Q5QJU3 1/20 0.38
NAAA Q02083 2/20 0.38
PRSS1 P07477 2/20 0.37
CTSG P08311 2/20 0.37
CTRB1 P17538 2/20 0.37
CMA1 P23946 2/20 0.37
MMP2 P08253 1/20 0.35
MMP9 P14780 1/20 0.35
MMP12 P39900 1/20 0.35
TRPA1 O75762 1/20 0.35
PTGS2 P35354 1/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 2/20 0.35
USP2 O75604 1/20 0.35
ALOX15 P16050 1/20 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
SCHEMBL12485912 1.00 CSNK1E (0.41) CSNK1ECES2CES1ALDH1A1ASAH1
SCHEMBL2279350 0.85 CSNK1E (0.41) CSNK1ECES2CES1ALDH1A1NAAA
SCHEMBL6695459 0.85 CSNK1E (0.41) CSNK1ECES2CES1ALDH1A1NAAA
SCHEMBL5706444 0.84 CSNK1E (0.40) CSNK1ECES2CES1ALDH1A1NAAA
SCHEMBL6689638 0.84 CSNK1E (0.39) CSNK1ECES2CES1ALDH1A1NAAA
SCHEMBL7597024 0.83 CES2 (0.41) CSNK1ECES2CES1ALDH1A1ASAH1
SCHEMBL11587804 0.83 GPR84 (0.44) CSNK1ECES2CES1ALDH1A1NAAA
SCHEMBL28204364 0.83 GPR84 (0.44) CSNK1ECES2CES1ALDH1A1NAAA
SCHEMBL8903692 0.83 CES2 (0.41) CSNK1ECES2CES1ALDH1A1ASAH1
SCHEMBL8910003 0.81 CES2 (0.40) CSNK1ECES2CES1ALDH1A1NAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2678310-A2 IMPROVED METAL SOLVENT EXTRACTION REAGENTS AND USE THEREOF Cognis IP Management GmbH (DE) 2014-01-01 EP claimed
WO-2012116292-A2 IMPROVED METAL SOLVENT EXTRACTION REAGENTS AND USE THEREOF COGNIS IP MANAGEMENT GMBH (DE) 2012-08-30 WO claimed
CN-108048653-B Improved metal solvent extraction reagents and uses thereof 考格尼斯知识产权管理有限责任公司 2020-03-03 CN disclosed
EP-2678310-A2 IMPROVED METAL SOLVENT EXTRACTION REAGENTS AND USE THEREOF Cognis IP Management GmbH (DE) 2014-01-01 EP disclosed
WO-2012116292-A2 IMPROVED METAL SOLVENT EXTRACTION REAGENTS AND USE THEREOF COGNIS IP MANAGEMENT GMBH (DE) 2012-08-30 WO disclosed
WO-2012116305-A2 METHODS OF METAL EXTRACTION USING OXIMES COGNIS IP MANAGEMENT GMBH (DE) 2012-08-30 WO disclosed