SCHEMBL10001677

SCHEMBL10001677

CN(C)CC(O)COCCOCC(O)CN(C)C

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.46
HIF1A Q16665 2/20 0.44
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
USP2 O75604 1/20 0.42
HTT P42858 2/20 0.41
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
SPHK1 Q9NYA1 1/20 0.37
HTR1A P08908 1/20 0.36
LPAR5 Q9H1C0 1/20 0.35
KDM4E B2RXH2 1/20 0.33
ABCB1 P08183 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
SCHEMBL10001679 0.93 HIF1A (0.44) HSD17B10HIF1ALMNASMN1; SMN2USP2
SCHEMBL14507015 0.93 HSD17B10 (0.56) HSD17B10HIF1ALMNASMN1; SMN2USP2
SCHEMBL347384 0.90 HIF1A (0.47) HSD17B10HIF1ALMNASMN1; SMN2USP2
SCHEMBL10001678 0.89 HSD17B10 (0.39) HSD17B10HIF1ALMNASMN1; SMN2USP2
SCHEMBL10001680 0.89 MEN1 (0.44) HSD17B10HIF1ALMNASMN1; SMN2USP2
SCHEMBL10884401 0.89 HSD17B10 (0.41) HSD17B10HIF1ALMNASMN1; SMN2USP2
SCHEMBL10001675 0.88 LMNA (0.40) HSD17B10HIF1ALMNASMN1; SMN2USP2
SCHEMBL18068171 0.87 HIF1A (0.46) HSD17B10HIF1ALMNASMN1; SMN2USP2
SCHEMBL258455 0.87 USP2 (0.55) HSD17B10HIF1ALMNASMN1; SMN2USP2
SCHEMBL2988607 0.83 USP2 (0.67) HSD17B10USP2HTTSPHK1LPAR5

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-8505743-B2 Surface modification of polyamide reverse osmosis membranes MICHIGAN MOLECULAR INSTITUTE (US) 2013-08-13 US disclosed
US-20120024789-A1 Surface Modification of Polyamide Reverse Osmosis Membranes MICHIGAN MOLECULAR INSTITUTE (US) 2012-02-02 US disclosed