SCHEMBL934393

SCHEMBL934393

COC(CCCNC1CCCCC1)OC

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
CXCR4 P61073 10/20 0.41
CXCL12 P48061 1/20 0.41
ALDH1A1 P00352 2/20 0.37

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
SCHEMBL935052 0.82 KDM4E (0.40) KDM4ECXCR4CXCL12ALDH1A1
SCHEMBL7058555 0.79 CXCR4 (0.44) KDM4ECXCR4CXCL12ALDH1A1
SCHEMBL730233 0.77 KDM4E (0.36) KDM4ECXCR4CXCL12ALDH1A1
SCHEMBL1246156 0.76 KDM4E (0.54) KDM4EALDH1A1
SCHEMBL1246086 0.76 KDM4E (0.54) KDM4EALDH1A1
SCHEMBL11932559 0.76 ALDH1A1 (0.46) KDM4ECXCR4CXCL12ALDH1A1
SCHEMBL2698028 0.76 KDM4E (0.54) KDM4EALDH1A1
SCHEMBL19148980 0.76 KDM4E (0.48) KDM4ECXCR4CXCL12ALDH1A1
SCHEMBL11057880 0.76 CXCR4 (0.42) KDM4ECXCR4CXCL12
SCHEMBL9417435 0.75 CXCR4 (0.61) KDM4ECXCR4CXCL12ALDH1A1

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-2011006808-A1 CROSS-LINKABLE ORGANOSILICON-BASED COMPOSITIONS WACKER CHEMIE AG (DE) 2011-01-20 WO disclosed