SCHEMBL2232212

SCHEMBL2232212

O=C(O)CCC1CCC(O)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 1/20 0.36
KDM7A Q6ZMT4 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
PHF8 Q9UPP1 1/20 0.36
KDM2A Q9Y2K7 1/20 0.36
MAPT P10636 2/20 0.35
ALDH1A1 P00352 2/20 0.34
FOLH1 Q04609 1/20 0.34
LMNA P02545 3/20 0.33
HPGD P15428 1/20 0.33
ALKBH5 Q6P6C2 1/20 0.33
SUCNR1 Q9BXA5 1/20 0.33
EGLN1 Q9GZT9 1/20 0.33
PTGFR P43088 2/20 0.33
PTGER3 P43115 2/20 0.33
ALOX5 P09917 1/20 0.32
EPHX2 P34913 1/20 0.32
HSD17B10 Q99714 2/20 0.32
THRB P10828 2/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL27581088 0.88 ALOX5 (0.42) KDM5AKDM7AKDM4CPHF8KDM2A
SCHEMBL5083120 0.86 KDM5A (0.42) KDM5AKDM7AKDM4CPHF8KDM2A
SCHEMBL8920891 0.81 KDM5A (0.47) KDM5AKDM7AKDM4CPHF8KDM2A
SCHEMBL672141 0.81 KDM5A (0.47) KDM5AKDM7AKDM4CPHF8KDM2A
SCHEMBL301024 0.81
SCHEMBL20520317 0.81 TDP1 (0.34) HPGDALOX5EPHX2KMT2ATDP1
Hydrochloric Acid SCHEMBL8026839 0.79
Water SCHEMBL15822499 0.79 KDM5A (0.46) KDM5AKDM7AKDM4CPHF8KDM2A
Bromide SCHEMBL15821114 0.79 KDM5A (0.46) KDM5AKDM7AKDM4CPHF8KDM2A
SCHEMBL14416501 0.77 HPGD (0.44) KDM5AKDM7AKDM4CPHF8KDM2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2348833-A2 LIQUID AQUEOUS CROP PROTECTION FORMULATIONS BASF SE (DE) 2011-08-03 EP disclosed
EP-2346322-A2 LIQUID PYRACLOSTROBIN-CONTAINING CROP PROTECTION FORMULATIONS BASF SE (DE) 2011-07-27 EP disclosed
WO-2010040835-A2 LIQUID PYRACLOSTROBIN-CONTAINING CROP PROTECTION FORMULATIONS BASF SE (DE) 2010-04-15 WO disclosed
WO-2010040834-A2 LIQUID AQUEOUS CROP PROTECTION FORMULATIONS BASF SE (DE) 2010-04-15 WO disclosed