SCHEMBL7919977

SCHEMBL7919977

OC(O)COCCOCCOCCOCCOCC(O)O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
USP2 O75604 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL881543 0.96 HSD17B10 (0.41) HSD17B10MEN1KMT2ATDP1USP2
SCHEMBL15253483 0.88 MEN1 (0.61) HSD17B10MEN1KMT2ATSHRMAPK1
SCHEMBL6666230 0.88 MEN1 (0.61) HSD17B10MEN1KMT2ATSHRMAPK1
SCHEMBL1170204 0.86 HSD17B10 (0.37) HSD17B10MEN1KMT2ATDP1USP2
SCHEMBL1006611 0.86 ALDH1A1 (0.43) HSD17B10MEN1KMT2ATSHRTDP1
SCHEMBL17148498 0.86 HTT (0.33) HSD17B10MEN1KMT2AHTT
SCHEMBL18827718 0.82
SCHEMBL5809530 0.82 ALDH1A1 (0.46) HSD17B10TSHRTDP1USP2HTT
SCHEMBL28100619 0.82 TSHR (0.52) HSD17B10MEN1KMT2ATSHRTDP1
SCHEMBL543942 0.81

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1083894-A1 MULTIBINDING INHIBITORS OF HMG-CoA REDUCTASE Advanced Medicine, Inc. (US) 2001-03-21 EP disclosed
WO-1999063994-A9 MULTIBINDING INHIBITORS OF HMG-CoA REDUCTASE ADVANCED MEDICINE INC (US) 2000-07-27 WO disclosed
WO-1999063994-A1 MULTIBINDING INHIBITORS OF HMG-CoA REDUCTASE ADVANCED MEDICINE, INC. (US) 1999-12-16 WO disclosed