Butadiene

Butadiene

SCHEMBL2526063

C=CC=C.C=CCCCCCCCCCCCCCC

nearest known ligand 0.89

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Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.89
ALDH1A1 P00352 1/20 0.68
THRB P10828 1/20 0.44
FAAH O00519 2/20 0.42
TRPV1 Q8NER1 1/20 0.42
DNM1 Q05193 3/20 0.41
ABCC4 O15439 1/20 0.41
MAPT P10636 1/20 0.41

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
Butadiene SCHEMBL28836829 1.00 TSHR (0.89) TSHRALDH1A1THRBFAAHTRPV1
Butadiene SCHEMBL11212332 1.00 TSHR (0.89) TSHRALDH1A1THRBFAAHTRPV1
Butadiene SCHEMBL6063844 1.00 TSHR (0.89) TSHRALDH1A1THRBFAAHTRPV1
Butadiene SCHEMBL28123856 0.97 TSHR (0.84) TSHRALDH1A1THRBFAAHTRPV1
Butadiene SCHEMBL28153896 0.97 TSHR (0.84) TSHRALDH1A1THRBFAAHTRPV1
SCHEMBL23539923 0.94 TSHR (1.00) TSHRALDH1A1THRBFAAHTRPV1
SCHEMBL11900218 0.94 TSHR (1.00) TSHRALDH1A1THRBFAAHTRPV1
SCHEMBL2848855 0.94 TSHR (1.00) TSHRALDH1A1THRBFAAHTRPV1
SCHEMBL22322880 0.94 TSHR (1.00) TSHRALDH1A1THRBFAAHTRPV1
SCHEMBL22164116 0.94 TSHR (1.00) TSHRALDH1A1THRBFAAHTRPV1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1656400-B1 CATALYTIC SYSTEM FOR THE PRODUCTION OF CONJUGATED DIENE/MONO-OLEFIN COPOLYMERS AND COPOLYMERS THEREOF MICHELIN & CIE (FR) 2019-05-29 EP disclosed
US-8039565-B2 Catalytic system for obtaining conjugated diene/mono-olefin copolymers and these copolymers MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2011-10-18 US disclosed
US-20090270578-A1 Catalytic system for obtaining conjugated diene/mono-olefin copolymers and these copolymers MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2009-10-29 US disclosed
US-7547654-B2 Catalytic system for obtaining conjugated diene/monoolefin copolymers and these copolymers MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2009-06-16 US disclosed
US-20060160969-A1 Catalytic system for obtaining conjugated diene/monoolefin copolymers and these copolymers MICHELIN RECHERCHE ET TECHNIQUE S.A. (CH) 2006-07-20 US disclosed
EP-1656400-A1 CATALYTIC SYSTEM FOR THE PRODUCTION OF CONJUGATED DIENE/MONO-OLEFIN COPOLYMERS AND COPOLYMERS THEREOF Société de Technologie Michelin (FR) 2006-05-17 EP disclosed
WO-2005028526-A1 CATALYTIC SYSTEM FOR THE PRODUCTION OF CONJUGATED DIENE/MONO-OLEFIN COPOLYMERS AND COPOLYMERS THEREOF SOCIETE DE TECHNOLOGIE MICHELIN (FR) 2005-03-31 WO disclosed