SCHEMBL2022809

SCHEMBL2022809

CCCCCCCCCCCCCCCC(=O)N(C)C(=O)CCCCCCCCCCCCCCC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.58
CES2 O00748 4/20 0.56
CES1 P23141 4/20 0.56
GPR84 Q9NQS5 7/20 0.54
PPARG P37231 7/20 0.54
PPARD Q03181 7/20 0.54
PPARA Q07869 7/20 0.54
HDAC11 Q96DB2 5/20 0.54
TSHR P16473 5/20 0.54
PTPN1 P18031 3/20 0.54
TLR2 O60603 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
FABP4 P15090 2/20 0.54
SLC22A6 Q4U2R8 1/20 0.54
SLC22A8 Q8TCC7 1/20 0.54
MEN1 O00255 1/20 0.54
ESR1 P03372 1/20 0.54
ALOX15 P16050 1/20 0.54
PDE4A P27815 1/20 0.54
KMT2A Q03164 1/20 0.54

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
SCHEMBL13715260 1.00 ALDH1A1 (0.58) ALDH1A1CES2CES1GPR84PPARG
SCHEMBL11308893 1.00 ALDH1A1 (0.58) ALDH1A1CES2CES1GPR84PPARG
SCHEMBL19457415 1.00 ALDH1A1 (0.58) ALDH1A1CES2CES1GPR84PPARG
SCHEMBL13715261 1.00 ALDH1A1 (0.58) ALDH1A1CES2CES1GPR84PPARG
SCHEMBL13715021 1.00 ALDH1A1 (0.58) ALDH1A1CES2CES1GPR84PPARG
SCHEMBL14533776 0.91 ALDH1A1 (0.54) ALDH1A1CES2CES1GPR84PPARG
SCHEMBL12522012 0.90 ALDH1A1 (0.71) ALDH1A1CES2CES1GPR84PPARG
SCHEMBL8033958 0.89 ALDH1A1 (0.52) ALDH1A1CES2CES1GPR84PPARG
SCHEMBL8031507 0.89 ALDH1A1 (0.52) ALDH1A1CES2CES1GPR84PPARG
SCHEMBL8031563 0.89 ALDH1A1 (0.52) ALDH1A1CES2CES1GPR84PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1512391-B1 COSMETIC HAIR PREPARATION KAO CORP (JP) 2011-11-02 EP disclosed
US-7964179-B2 Cosmetic hair preparation KAO CORPORATION (JP) 2011-06-21 US disclosed
US-20050255074-A1 Cosmetic hair preparation KAO CORPORATION (JP) 2005-11-17 US disclosed
EP-1512391-A1 COSMETIC HAIR PREPARATION Kao Corporation (JP) 2005-03-09 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-20050255074-A1 Cosmetic hair preparation POLR1C, H1-5, H1-0 ALDH1A1 1569/4885CES2 675/4885CES1 3206/4885

“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.