SCHEMBL3210119

SCHEMBL3210119

C=C(C(=O)OCCN)C(C)C.C=C(C)C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
TSHR P16473 3/20 0.44
THRB P10828 1/20 0.39
POLB P06746 1/20 0.30
APEX1 P27695 1/20 0.30
HTT P42858 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL6568101 0.90 TSHR (0.51) ALDH1A1TSHRTHRBPOLBAPEX1
SCHEMBL41031 0.88 TSHR (0.36) TSHRTHRB
Acetic Acid SCHEMBL8433810 0.86 TSHR (0.37) TSHRTHRB
Hydrochloric Acid SCHEMBL2533776 0.86 TSHR (0.35) TSHRTHRB
Ammonia Solution, Strong SCHEMBL3663515 0.86 TSHR (0.35) TSHRTHRB
SCHEMBL11101921 0.86 ALDH1A1 (0.60) ALDH1A1TSHRTHRBPOLBAPEX1
SCHEMBL10757690 0.86 THRB (0.49) ALDH1A1TSHRTHRBPOLBAPEX1
Chloromethane SCHEMBL543091 0.84 TSHR (0.34) TSHRTHRB
Sulfuric Acid SCHEMBL5068577 0.81 TSHR (0.32) TSHRTHRB
SCHEMBL7527694 0.81 TSHR (0.67) ALDH1A1TSHRTHRBPOLBAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8187580-B2 Polymeric assisted delivery using separate addition THE PROCTER & GAMBLE COMPANY (US) 2012-05-29 US disclosed
US-7795201-B2 Personal care compositions DOW GLOBAL TECHNOLOGIES 2010-09-14 US disclosed
US-7642329-B2 Acrylate or methacrylate ester of low molecular weight oligomeric lactide copolymerized with vinyl pyridine; for dissolving drugs in solution COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2010-01-05 US disclosed
EP-1562542-B1 PERFUME POLYMERIC PARTICLES PROCTER & GAMBLE (US) 2009-10-14 EP disclosed
US-20080206168-A1 Personal Care Compositions UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION 2008-08-28 US disclosed
US-7316994-B2 Perfume polymeric particles THE PROCTER & GAMBLE COMPANY (US) 2008-01-08 US disclosed
EP-1838280-A2 PERSONAL CARE COMPOSITIONS Dow Global Technologies Inc. (US) 2007-10-03 EP disclosed
US-20070072996-A1 Oligomeric lactide macromer based copolymer and a process for the preparation thereof COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2007-03-29 US disclosed
WO-2006076065-A2 PERSONAL CARE COMPOSITIONS DOW GLOBAL TECHNOLOGIES INC. (US) 2006-07-20 WO disclosed
EP-1562542-A1 PERFUME POLYMERIC PARTICLES THE PROCTER & GAMBLE COMPANY (US) 2005-08-17 EP disclosed
US-20040110648-A1 Perfume polymeric particles PROCTER & GAMBLE COMPANY, THE 2004-06-10 US disclosed
WO-2004041232-A1 PERFUME POLYMERIC PARTICLES THE PROCTER & GAMBLE COMPANY (US) 2004-05-21 WO disclosed
US-20040087476-A1 Utilizing cationic copolymer aftertreatment for longer lasting benefit PROCTER & GAMBLE COMPANY, THE 2004-05-06 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-20040087476-A1 Utilizing cationic copolymer aftertreatment for longer lasting benefit VEGFA, NACA, POLR1C ALDH1A1 2765/4885TSHR 2195/4885THRB 3311/4885

“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.