SCHEMBL17009292

SCHEMBL17009292

O=C(O)CCNCNCCCCNO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.39
ECE1 P42892 1/20 0.38
LTA4H P09960 2/20 0.37
ADRA1A P35348 1/20 0.36
LMNA P02545 3/20 0.36
SLC22A6 Q4U2R8 1/20 0.36
ALDH1A1 P00352 1/20 0.35
TSHR P16473 1/20 0.35
NFKB1 P19838 1/20 0.35
PMP22 Q01453 1/20 0.35
EGLN1 Q9GZT9 2/20 0.34
KDM4E B2RXH2 1/20 0.34
KDM6B O15054 1/20 0.34
KDM5C P41229 1/20 0.34
FOLH1 Q04609 1/20 0.34
PHF8 Q9UPP1 1/20 0.34
KDM2A Q9Y2K7 1/20 0.34
S1PR1 P21453 4/20 0.34
S1PR3 Q99500 2/20 0.34
ALKBH5 Q6P6C2 1/20 0.33

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
SCHEMBL12935681 0.81 PRMT1 (0.48) PRMT1ECE1LTA4HADRA1ALMNA
SCHEMBL3130249 0.79 PAOX (0.52) SLC22A6ALDH1A1TSHRS1PR1S1PR3
SCHEMBL2804324 0.79 PRMT1 (0.52) PRMT1LTA4HADRA1ALMNASLC22A6
SCHEMBL30407212 0.79 PRMT1 (0.46) PRMT1ECE1LTA4HADRA1ALMNA
SCHEMBL4941181 0.79
SCHEMBL39829 0.77 TSHR (0.63) PRMT1ADRA1ALMNASLC22A6ALDH1A1
SCHEMBL6902609 0.77 TSHR (0.63) PRMT1ADRA1ALMNASLC22A6ALDH1A1
SCHEMBL20518454 0.77 TSHR (0.63) PRMT1ADRA1ALMNASLC22A6ALDH1A1
SCHEMBL6900773 0.77 TSHR (0.63) PRMT1ADRA1ALMNASLC22A6ALDH1A1
SCHEMBL6899587 0.77 TSHR (0.63) PRMT1ADRA1ALMNASLC22A6ALDH1A1

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
EP-3104867-A1 COMPOSITIONS AND METHODS TO IMPROVE THE HOMING AND GRAFTING OF HEMATOPOETIC STEM CELLS 7 HILLS INTERESTS, LLC (US) 2016-12-21 EP disclosed
WO-2015123447-A1 COMPOSITIONS AND METHODS TO IMPROVE THE HOMING AND GRAFTING OF HEMATOPOETIC STEM CELLS 7 HILLS PHARMA, LLC (US) 2015-08-20 WO disclosed