SCHEMBL5824294

SCHEMBL5824294

CC1(C)C2CCC1(C)C(OCCOCCOC1CC3CCC1(C)C3(C)C)C2

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
KMT2A Q03164 4/20 0.51
KDM4E B2RXH2 2/20 0.51
LMNA P02545 5/20 0.48
HTT P42858 4/20 0.48
MEN1 O00255 3/20 0.48
MAPT P10636 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
PLA2G1B P04054 1/20 0.46
MAPK1 P28482 1/20 0.46
RAD52 P43351 1/20 0.46
ATG4B Q9Y4P1 1/20 0.46

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
SCHEMBL5824224 1.00 ALDH1A1 (0.54) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL7688059 0.96 ALDH1A1 (0.56) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL7686932 0.92 KMT2A (0.49) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL7689239 0.92 KMT2A (0.49) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL31350080 0.87 KMT2A (0.46) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL2848279 0.86 KMT2A (0.52) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL4931645 0.86 KMT2A (0.52) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL10408482 0.86 ALDH1A1 (0.51) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL10408480 0.86 ALDH1A1 (0.51) ALDH1A1KMT2AKDM4ELMNAHTT
SCHEMBL4669733 0.84 ALDH1A1 (0.50) ALDH1A1KMT2AKDM4ELMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060128575-A1 Traction fluid composition GEIGER RENE 2006-06-15 US disclosed
US-6395689-B1 TRACTION FLUID, PERFUMES, CHEMICAL INTERMEDIATES, SOLVENTS CLARIANT GMBH (DE) 2002-05-28 US disclosed