SCHEMBL9813359

SCHEMBL9813359

CC(=O)OC1CCCCCCCCCCCC1=O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.52
HSD17B10 Q99714 1/20 0.52
MAPT P10636 1/20 0.51
ALDH1A1 P00352 5/20 0.50
POLB P06746 3/20 0.50
USP2 O75604 1/20 0.50
LMNA P02545 1/20 0.50
KMT2A Q03164 2/20 0.45
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA4 P22748 1/20 0.42
PKM P14618 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
HTT P42858 1/20 0.41
MEN1 O00255 1/20 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
SCHEMBL11093553 1.00 KDM4E (0.52) KDM4EHSD17B10MAPTALDH1A1POLB
SCHEMBL9813351 1.00 KDM4E (0.52) KDM4EHSD17B10MAPTALDH1A1POLB
SCHEMBL11091255 1.00 KDM4E (0.52) KDM4EHSD17B10MAPTALDH1A1POLB
SCHEMBL22324061 0.98 MAPT (0.52) KDM4EHSD17B10MAPTALDH1A1POLB
SCHEMBL22323590 0.98 MAPT (0.52) KDM4EHSD17B10MAPTALDH1A1POLB
SCHEMBL6028694 0.98 MAPT (0.52) KDM4EHSD17B10MAPTALDH1A1POLB
SCHEMBL3830715 0.92 MAPT (0.47) KDM4EHSD17B10MAPTALDH1A1POLB
SCHEMBL27486927 0.90 MAPT (0.46) KDM4EHSD17B10MAPTALDH1A1POLB
SCHEMBL29730977 0.84
SCHEMBL28392227 0.83 MAPT (0.42) KDM4EHSD17B10MAPTALDH1A1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0230499-B1 PROCESS FOR PREPARING MACROCYCLIC KETONES NIPPON MINING COMPANY LIMITED (JP) 1991-07-03 EP disclosed
US-4700007-A PERFORMING ACYLOIN CONDENSATION AND REDUCTION REACTIONS IN ONE WATER-IMMISCIBLE SOLVENT SOLUTION NIPPON MINING CO., LTD. (JP) 1987-10-13 US disclosed
EP-0230499-A1 Process for preparing macrocyclic ketones NIPPON MINING COMPANY LIMITED (JP) 1987-08-05 EP disclosed