SCHEMBL13595807

SCHEMBL13595807

CCCOCCOCC(CO)CO

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.50
USP2 O75604 1/20 0.45
TDP1 Q9NUW8 1/20 0.42
HTT P42858 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
THRB P10828 1/20 0.37
MAPT P10636 1/20 0.37
TSHR P16473 1/20 0.36
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
CYP3A4 P08684 1/20 0.34
LPAR5 Q9H1C0 1/20 0.31

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
SCHEMBL21392856 0.86 ALDH1A1 (0.52) HSD17B10USP2TDP1HTTMEN1
SCHEMBL17278043 0.81 USP2 (0.55) HSD17B10USP2HTTMEN1KMT2A
SCHEMBL27953890 0.81 USP2 (0.67) HSD17B10USP2TDP1HTTMEN1
SCHEMBL12752105 0.81 MEN1 (0.33) HSD17B10USP2MEN1KMT2A
SCHEMBL20927199 0.79 HSD17B10 (0.54) HSD17B10USP2TDP1HTTMEN1
SCHEMBL22219040 0.79 ALDH1A1 (0.39) HSD17B10USP2HTTMEN1KMT2A
SCHEMBL21046022 0.77 USP2 (0.68) USP2HTTMEN1KMT2ATHRB
SCHEMBL21046018 0.77 USP2 (0.68) USP2HTTMEN1KMT2ATHRB
SCHEMBL21046040 0.77 USP2 (0.68) USP2HTTMEN1KMT2ATHRB
SCHEMBL16367888 0.77 USP2 (0.68) USP2HTTMEN1KMT2ATHRB

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-8546616-B2 Polyetheramine macromonomers comprising two neighboring hydroxyl groups and their use for producing polyurethanes CLARIANT FINANCE (BVI) LIMITED (VG) 2013-10-01 US disclosed
US-20090318656-A1 Polyetheramine Macromonomers Comprising Two Neighboring Hydroxyl Groups And Their Use For Producing Polyurethanes CLARIANT INTERNATIONAL LTD. (CH) 2009-12-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090318656-A1 Polyetheramine Macromonomers Comprising Two Neighboring Hydroxyl Groups And Their Use For Producing Polyurethanes PNMT, BHMT2, PUF60 HSD17B10 1190/4885USP2 483/4885TDP1 1673/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.