SCHEMBL4036124

SCHEMBL4036124

CCCCCCCCCCCCCCCC[C](C)CCCCCCCCCCCCCCCC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.55
CES1 P23141 4/20 0.55
TSHR P16473 5/20 0.53
THRB P10828 1/20 0.53
GPR84 Q9NQS5 7/20 0.52
PPARG P37231 7/20 0.52
PPARD Q03181 7/20 0.52
PPARA Q07869 7/20 0.52
HDAC11 Q96DB2 5/20 0.52
PTPN1 P18031 3/20 0.52
ALDH1A1 P00352 2/20 0.52
TLR2 O60603 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
FABP4 P15090 2/20 0.52
SLC22A6 Q4U2R8 1/20 0.52
SLC22A8 Q8TCC7 1/20 0.52
MEN1 O00255 1/20 0.52
ESR1 P03372 1/20 0.52
ALOX15 P16050 1/20 0.52
PDE4A P27815 1/20 0.52

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
SCHEMBL2186772 1.00 CES2 (0.55) CES2CES1TSHRTHRBGPR84
SCHEMBL9487785 1.00 CES2 (0.55) CES2CES1TSHRTHRBGPR84
SCHEMBL14798823 1.00 CES2 (0.55) CES2CES1TSHRTHRBGPR84
SCHEMBL8675151 1.00 CES2 (0.55) CES2CES1TSHRTHRBGPR84
SCHEMBL5134029 1.00 CES2 (0.55) CES2CES1TSHRTHRBGPR84
SCHEMBL16712189 1.00 CES2 (0.55) CES2CES1TSHRTHRBGPR84
SCHEMBL11172049 1.00 CES2 (0.55) CES2CES1TSHRTHRBGPR84
SCHEMBL247451 1.00 CES2 (0.55) CES2CES1TSHRTHRBGPR84
SCHEMBL1192143 1.00 CES2 (0.55) CES2CES1TSHRTHRBGPR84
SCHEMBL8330537 1.00 CES2 (0.55) CES2CES1TSHRTHRBGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008081348-A2 METHOD AND COMPOSITION FOR PERMANENTLY SHAPING HAIR THE PROCTER & GAMBLE COMPANY (US) 2008-07-10 WO claimed
EP-2862561-B1 Method for conditioning hair with an aerosol cream mousse PROCTER & GAMBLE (US) 2019-10-30 EP disclosed
EP-2090295-B2 Method and composition for reducing the drying time of hair PROCTER & GAMBLE (US) 2018-08-22 EP disclosed
EP-2090295-B1 Method and composition for reducing the drying time of hair Wella GmbH (DE) 2015-08-26 EP disclosed
CN-101568579-B Plasticizer for resin and resin composition containing the same IDEMITSU KOSAN CO 2012-07-18 CN disclosed
CN-101568579-A Plasticizer for resin and resin composition containing the same IDEMITSU KOSAN CO (JP) 2009-10-28 CN disclosed
WO-2009101546-A1 METHOD AND COMPOSITION FOR REDUCING THE DRYING TIME OF HAIR THE PROCTER & GAMBLE COMPANY (US) 2009-08-20 WO disclosed
WO-2008081348-A2 METHOD AND COMPOSITION FOR PERMANENTLY SHAPING HAIR THE PROCTER & GAMBLE COMPANY (US) 2008-07-10 WO disclosed
US-20080025937-A1 Method and composition for permanently shaping hair PROCTER & GAMBLE COMPANY, THE 2008-01-31 US disclosed
EP-1752133-A1 Use of polymeric thickeners in hair treating compositions, method and composition Wella Aktiengesellschaft (DE) 2007-02-14 EP 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-20080025937-A1 Method and composition for permanently shaping hair DNMT3A, DNMT1, NACA CES2 1906/4885CES1 3327/4885TSHR 2006/4885

“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.