SCHEMBL6237606

SCHEMBL6237606

CCCCC1(C)CCC(C)(C)N1O

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
PKM P14618 1/20 0.31

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
SCHEMBL6236211 0.86
SCHEMBL6236418 0.79 GAA (0.30)
SCHEMBL13464078 0.76 KDM4E (0.31) KDM4EPKM
SCHEMBL6237604 0.74 HSD17B10 (0.32) KDM4EPKM
SCHEMBL17931807 0.70
SCHEMBL244419 0.69 GAA (0.39)
SCHEMBL8925363 0.68 GRIN2D (0.32)
SCHEMBL4553767 0.68 OPRM1 (0.35)
SCHEMBL6234400 0.68 CYP2C19 (0.33)
Hydrochloric Acid SCHEMBL4555270 0.67 OPRM1 (0.34)

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
WO-2005003759-A1 A METHOD FOR ANALYSIS OF A BEVERAGE NATIONAL UNIVERSITY OF SINGAPORE (SG) 2005-01-13 WO disclosed