SCHEMBL4435959

SCHEMBL4435959

C=CC=CC.C=CCCCCCCC

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.70
ALDH1A1 P00352 2/20 0.54
FAAH O00519 2/20 0.35
TRPV1 Q8NER1 1/20 0.35
THRB P10828 1/20 0.35
ABCC4 O15439 1/20 0.34
MAPT P10636 1/20 0.34
LMNA P02545 1/20 0.34
LPAR3 Q9UBY5 1/20 0.34

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
Octane SCHEMBL11686367 0.89 TSHR (0.48) TSHRALDH1A1THRBLMNA
SCHEMBL23302324 0.86
SCHEMBL29502815 0.86 TSHR (0.94) TSHRALDH1A1FAAHTRPV1THRB
Hexane SCHEMBL27853321 0.86 TSHR (0.43) TSHRALDH1A1THRBLMNA
Butadiene SCHEMBL28836829 0.84 TSHR (0.89) TSHRALDH1A1FAAHTRPV1THRB
Propene SCHEMBL3793399 0.84 TSHR (0.89) TSHRALDH1A1FAAHTRPV1THRB
Propene SCHEMBL27442990 0.84 TSHR (0.89) TSHRALDH1A1FAAHTRPV1THRB
Butadiene SCHEMBL6063844 0.84 TSHR (0.89) TSHRALDH1A1FAAHTRPV1THRB
Propene SCHEMBL1505857 0.84 TSHR (0.89) TSHRALDH1A1FAAHTRPV1THRB
Propene SCHEMBL27644482 0.84 TSHR (0.89) TSHRALDH1A1FAAHTRPV1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2846876-A2 HAIR REMOVAL COMPOSITIONS Reckitt & Colman (Overseas) Limited (GB) 2015-03-18 EP disclosed
WO-2013160690-A2 NOVEL HAIR REMOVAL COMPOSITIONS RECKITT & COLMAN (OVERSEAS) LIMITED (GB) 2013-10-31 WO disclosed
EP-2120850-B1 EPILATORY COMPOSITIONS RECKITT & COLMAN OVERSEAS (GB) 2013-10-23 EP disclosed
EP-2120850-A1 EPILATORY COMPOSITIONS Beckitt Benckiser (UK) Limited (GB) 2009-11-25 EP disclosed
WO-2008102125-A1 EPILATORY COMPOSITIONS RECKITT BENCKISER (UK) LIMITED (GB) 2008-08-28 WO disclosed