SCHEMBL220825

SCHEMBL220825

C=Cc1ccc(C(C)CO)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
ABCB11 O95342 1/20 0.41
TRPA1 O75762 3/20 0.38
TAS1R3 Q7RTX0 2/20 0.37
TAS1R1 Q7RTX1 2/20 0.37
TDP1 Q9NUW8 1/20 0.36
TSHR P16473 1/20 0.36
HDAC8 Q9BY41 1/20 0.35
ESR1 P03372 1/20 0.35
ESR2 Q92731 1/20 0.35
PTGS2 P35354 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TYR P14679 1/20 0.34
CYP2C9 P11712 1/20 0.33
STAT3 P40763 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33

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
SCHEMBL5203081 0.84 ALDH1A1 (0.42) ALDH1A1TRPA1TAS1R3TAS1R1TDP1
SCHEMBL2641075 0.82 ABCB11 (0.52) ABCB11TRPA1TDP1TSHRESR1
SCHEMBL383658 0.81 ALDH1A1 (0.39) ALDH1A1TRPA1TAS1R3TAS1R1TDP1
SCHEMBL11517329 0.81 ALDH1A1 (0.48) ALDH1A1TAS1R3TAS1R1TSHRHDAC8
SCHEMBL716407 0.81 ALDH1A1 (0.48) ALDH1A1TAS1R3TAS1R1TSHRHDAC8
SCHEMBL2467595 0.79 ALDH1A1 (0.46) ALDH1A1TAS1R3TAS1R1TDP1TSHR
SCHEMBL3671591 0.79 ALDH1A1 (0.46) ALDH1A1TAS1R3TAS1R1TDP1TSHR
SCHEMBL2490657 0.79 ABCB11 (0.41) ABCB11TRPA1ESR1ESR2PTGS2
SCHEMBL1207977 0.78 ALDH1A1 (0.50) ALDH1A1TRPA1TAS1R3TAS1R1TDP1
SCHEMBL5681566 0.78 ALDH1A1 (0.50) ALDH1A1TAS1R3TAS1R1TDP1TSHR

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 121 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101535346-B Arborescent polymers and process for making same UNIV AKRON 2014-08-20 CN claimed
US-8748530-B2 Arborescent polymers and process for making same THE UNIVERSITY OF AKRON (US) 2014-06-10 US claimed
US-20130303688-A1 ARBORESCENT POLYMERS AND PROCESS FOR MAKING SAME LANXESS INC (CA) 2013-11-14 US claimed
US-8580917-B2 Method of purifying block copolymers THE UNIVERSITY OF AKRON (US) 2013-11-12 US claimed
US-20130261250-A1 ARBORESCENT POLYMERS HAVING A CORE WITH A HIGH GLASS TRANSITION TEMPERATURE AND PROCESS FOR MAKING SAME LANXESS INC. (CA) 2013-10-03 US claimed
CN-103319633-A Method of purifying block copolymers UNIV AKRON 2013-09-25 CN claimed
EP-2019844-B1 METHOD OF PURIFYING BLOCK COPOLYMERS UNIV AKRON (US) 2013-09-11 EP claimed
CN-101472953-B Method for purifying block copolymer UNIV AKRON 2013-07-31 CN claimed
US-20130144021-A1 ARBORESCENT POLYMERS AND PROCESS FOR MAKING SAME LANXESS, INC. (CA) 2013-06-06 US claimed
US-20130102711-A1 METHOD OF PURIFYING BLOCK COPOLYMERS THE UNIVERSITY OF AKRON (US) 2013-04-25 US claimed
CN-100455615-C Arborescent thermoplastic elastomers and products therefrom UNIV WESTERN ONTARIO (CA) 2009-01-28 CN claimed
WO-2008027589-A2 ARBORESCENT POLYMERS AND PROCESS FOR MAKING SAME THE UNIVERSITY OF AKRON (US) 2008-03-06 WO claimed
WO-2007136700-A2 METHOD OF PURIFYING BLOCK COPOLYMERS THE UNIVERSITY OF AKRON (US) 2007-11-29 WO claimed
CN-1604923-A Arborescent thermoplastic elastomers and products thereof UNIV WESTERN ONTARIO (CA) 2005-04-06 CN claimed
JP-2004526857-A 2004-09-02 JP claimed
US-6747098-B2 A BRANCHED BLOCK COPOLYMER COMPRISING A LOW GLASS TRANSITION TEMPERATURE SOFT SEGMENTS AND RIGID SEGMENTS WITH A HIGH TRANSITION TEMPERATURE OR CRYSTALLINE MELTING POINT; NON-BIODEGRADABLE IMPLANTABLE PROSTHESUS THE UNIVERSITY OF WESTERN ONTARIO (CA) 2004-06-08 US claimed
EP-1395622-A1 ARBORESCENT THERMOPLASTIC ELASTOMERS AND PRODUCTS THEREFROM THE UNIVERSITY OF WESTERN ONTARIO (CA) 2004-03-10 EP claimed
CN-1431235-A Method for preparing hyperbranched polymers and its preparing method UNIV SHANGHAI JIAOTONG (CN) 2003-07-23 CN claimed
US-20030065098-A1 Arborescent thermoplastic elastomers and products therefrom AUSTIN VENTURE PARTNERS, LLC 2003-04-03 US claimed
WO-2002096967-A1 ARBORESCENT THERMOPLASTIC ELASTOMERS AND PRODUCTS THEREFROM THE UNIVERSITY OF WESTERN ONTARIO (CA) 2002-12-05 WO claimed