SCHEMBL9964654

SCHEMBL9964654

CC(O)COC(=O)OCC(C)OC(=O)OCC(C)O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.40
TSHR P16473 3/20 0.38
TDP1 Q9NUW8 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
NFKB1 P19838 1/20 0.33
PTGS1 P23219 1/20 0.33
APEX1 P27695 1/20 0.33
THPO P40225 1/20 0.33
PMP22 Q01453 1/20 0.33
KMT2A Q03164 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL15383092 0.92 TDP1 (0.39) MAPTTSHRTDP1MEN1LMNA
SCHEMBL17194014 0.92 MAPT (0.36) MAPTTSHRTDP1MEN1LMNA
SCHEMBL12262572 0.92 MAPT (0.36) MAPTTSHRTDP1MEN1LMNA
SCHEMBL11986265 0.92 TDP1 (0.39) MAPTTSHRTDP1MEN1LMNA
SCHEMBL15383093 0.92 MAPT (0.38) MAPTTSHRTDP1MAPK1HSD17B10
SCHEMBL15441005 0.89 MAPT (0.39) MAPTTSHRTDP1MAPK1HSD17B10
SCHEMBL15780104 0.89 MAPT (0.41) MAPTTSHRTDP1
SCHEMBL11986256 0.88 MAPT (0.51) MAPTTSHRTDP1ALDH1A1MEN1
SCHEMBL15180215 0.88 MAPT (0.43) MAPTTSHR
SCHEMBL12262552 0.88 TSHR (0.44) MAPTTSHRTDP1ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9884937-B2 Polymer compositions and methods SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2018-02-06 US disclosed
US-9834710-B2 Adhesive compositions and methods SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2017-12-05 US disclosed
US-9738784-B2 Polymer blends NOVOMER, INC. (US) 2017-08-22 US disclosed
US-9738784-B2 Polymer blends NOVOMER, INC. (US) 2017-08-22 US disclosed
US-20170145147-A1 HIGH STRENGTH POLYURETHANE FOAM COMPOSITIONS AND METHODS NOVOMER, INC. 2017-05-25 US disclosed
US-20170107241-A1 SALEN COMPLEXES WITH DIANIONIC COUNTERIONS NOVOMER, INC. (US) 2017-04-20 US disclosed
US-20160319064-A1 POLYMER COMPOSITIONS AND METHODS SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2016-11-03 US disclosed
US-9403861-B2 Salen complexes with dianionic counterions NOVOMER, INC. (US) 2016-08-02 US disclosed
US-20150344751-A1 ADHESIVE COMPOSITIONS AND METHODS SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2015-12-03 US disclosed
US-20150083326-A1 ADHESIVE COMPOSITIONS AND METHODS SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2015-03-26 US disclosed
US-20140336354-A1 SALEN COMPLEXES WITH DIANIONIC COUNTERIONS SAUDI ARAMCO TECHNOLOGIES COMPANY (SA) 2014-11-13 US disclosed
US-8748555-B2 Structurally precise poly(propylene carbonate) compositions NOVOMER, INC. (US) 2014-06-10 US disclosed
US-20130209775-A1 POLYMER BLENDS NOVOMER, INC. (US) 2013-08-15 US disclosed
US-20130209775-A1 POLYMER BLENDS NOVOMER, INC. (US) 2013-08-15 US disclosed
US-20120156410-A1 STRUCTURALLY PRECISE POLY(PROPYLENE CARBONATE) COMPOSITIONS NOVOMER, INC. (US) 2012-06-21 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 (2 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-20170107241-A1 SALEN COMPLEXES WITH DIANIONIC COUNTERIONS NCLN, POLN, NCL MAPT 1373/4885TSHR 4704/4885TDP1 3455/4885
US-20140336354-A1 SALEN COMPLEXES WITH DIANIONIC COUNTERIONS NCLN, POLN, NCL MAPT 1373/4885TSHR 4704/4885TDP1 3455/4885

“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.