SCHEMBL7635456

SCHEMBL7635456

CCCCCC[C](C)OOC(=O)c1cccc(OC)c1OC

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
KMT2A Q03164 1/20 0.46
HPGD P15428 1/20 0.44
PPARA Q07869 1/20 0.42
KDM4E B2RXH2 2/20 0.41
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
EPHX2 P34913 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC1 Q13547 1/20 0.40

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
SCHEMBL7631328 0.89 EPHX2 (0.43) KMT2APPARAGAAEPHX2
SCHEMBL7627885 0.88 HDAC8 (0.48) KMT2AHPGDPPARAKDM4ERAB9A
SCHEMBL7632705 0.84 PPARA (0.52) KMT2APPARAALDH1A1HDAC1
SCHEMBL7625284 0.84 POLB (0.52) POLBKMT2AHPGDKDM4ERAB9A
SCHEMBL6263649 0.81 KMT2A (0.59) POLBKMT2AHPGDKDM4ERAB9A
SCHEMBL28189525 0.81 KMT2A (0.49) POLBKMT2AHPGDPPARAKDM4E
SCHEMBL7631426 0.80 KMT2A (0.54) POLBKMT2AHPGDKDM4ERAB9A
SCHEMBL7627740 0.80 LMNA (0.50) KMT2AKDM4EALDH1A1GAAHDAC1
SCHEMBL7628311 0.79 KMT2A (0.50) KMT2APPARAGAAEPHX2
SCHEMBL27924926 0.79 ALDH1A1 (0.66) POLBKMT2AHPGDKDM4ERAB9A

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
EP-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed