SCHEMBL5669656

SCHEMBL5669656

C=CC/C(CCC)=C(/O)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FFAR3 O14843 3/20 0.37
HDAC3 O15379 3/20 0.37
HDAC1 Q13547 3/20 0.37
HDAC2 Q92769 3/20 0.37
HDAC8 Q9BY41 3/20 0.37
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
TSHR P16473 3/20 0.32
FAAH O00519 1/20 0.32
ALDH1A1 P00352 2/20 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
SCHEMBL729717 0.82 LMNA (0.33) TSHRALDH1A1
SCHEMBL12080810 0.79 HDAC3 (0.50) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL8071528 0.77 TSHR (0.36) CES2CES1TSHRALDH1A1
SCHEMBL7150118 0.76 CES1 (0.46) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL3019506 0.76 CES1 (0.46) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL15229727 0.75 FFAR3 (0.46) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL9651120 0.75 FFAR3 (0.46) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL28953060 0.75 FFAR3 (0.46) FFAR3HDAC3HDAC1HDAC2HDAC8
SCHEMBL8845045 0.73 TSHR (0.33) TSHRALDH1A1
SCHEMBL8845043 0.73 TSHR (0.33) TSHRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7025954-B2 Materials for reshaping of essentially rigid keratinaceous surfaces ESSTECH, INC. (US) 2006-04-11 US disclosed
EP-1148862-A4 MATERIALS AND METHODS FOR RESHAPING OF ESSENTIALLY KERATINACEOUS SURFACES ESSCHEM INC (US) 2006-01-04 EP disclosed
US-20030215635-A1 Materials for reshaping of essentially rigid keratinaceous surfaces ESSTECH, INC. 2003-11-20 US disclosed
EP-1148862-A1 MATERIALS AND METHODS FOR RESHAPING OF ESSENTIALLY KERATINACEOUS SURFACES Esschem, Inc. (US) 2001-10-31 EP disclosed
WO-2000045775-A1 MATERIALS AND METHODS FOR RESHAPING OF ESSENTIALLY KERATINACEOUS SURFACES ESSCHEM, INC. (US) 2000-08-10 WO disclosed
US-6080389-A Materials and methods for reshaping of essentially rigid keratinaceous surfaces ESSCHEM, INC. (US) 2000-06-27 US disclosed