Butadiene

Butadiene

SCHEMBL382147

C=CC=C.CCCCCCCl

nearest known ligand 0.72

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.72
ALDH1A1 P00352 3/20 0.72
TDP1 Q9NUW8 1/20 0.53
THRB P10828 1/20 0.44
FAAH O00519 1/20 0.38
PLA2G1B P04054 1/20 0.36
HSP90AA1 P07900 1/20 0.36
RAD52 P43351 1/20 0.36
ATG4B Q9Y4P1 1/20 0.36
ZDHHC20 Q5W0Z9 1/20 0.35
ZDHHC2 Q9UIJ5 1/20 0.35
DNM1 Q05193 5/20 0.35
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SLC22A1 O15245 1/20 0.35

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 SCHEMBL28906738 0.97 TSHR (0.67) TSHRALDH1A1TDP1THRBFAAH
Propene SCHEMBL21633519 0.86 TSHR (0.68) TSHRALDH1A1TDP1THRBFAAH
Propene SCHEMBL25422704 0.86
SCHEMBL11742005 0.85 TSHR (1.00) TSHRALDH1A1TDP1THRBFAAH
SCHEMBL5575281 0.85 TSHR (1.00) TSHRALDH1A1TDP1THRBFAAH
Hexane SCHEMBL8333520 0.85 TSHR (1.00) TSHRALDH1A1TDP1THRBFAAH
SCHEMBL5575823 0.85 TSHR (1.00) TSHRALDH1A1TDP1THRBFAAH
SCHEMBL22186971 0.85 TSHR (1.00) TSHRALDH1A1TDP1THRBFAAH
Octane SCHEMBL4515243 0.85 TSHR (0.61) TSHRALDH1A1THRBDNM1LMNA
SCHEMBL4063990 0.85 TSHR (1.00) TSHRALDH1A1TDP1THRBFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9297800-B2 Biomaterial construct, its producing method, biomaterial support, target material purifying method, affinity chromatography container, separation chip, analyzing method and analyzing separator for target material, biomaterial complex, and its support, sensor chip, solid support with biomaterial fixed thereon MITSUBISHI CHEMICAL CORPORATION (JP) 2016-03-29 US disclosed
EP-2339342-B1 Biomaterial structure, method of producing the same and uses thereof LSI MEDIENCE CORP (JP) 2014-11-12 EP disclosed
US-8183057-B2 Biomaterial construct, its producing method, biomaterial support, target material purifying method, affinity chromatography container, separation chip, analyzing method and analyzing separator for target material, biomaterial complex, and its support, sensor chip, solid support with biomaterial fixed thereon MITSUBISHI CHEMICAL CORPORATION (JP) 2012-05-22 US disclosed
US-20120053078-A1 BIOMATERIAL CONSTRUCT, ITS PRODUCING METHOD, BIOMATERIAL SUPPORT, TARGET MATERIAL PURIFYING METHOD, AFFINITY CHROMATOGRAPHY CONTAINER, SEPARATION CHIP, ANALYZING METHOD AND ANALYZING SEPARATOR FOR TARGET MATERIAL, BIOMATERIAL COMPLEX, AND ITS SUPPORT, SENSOR CHIP, SOLID SUPPORT WITH BIOMATERIAL FIXED THEREON MITSUBISHI CHEMICAL CORPORATION (JP) 2012-03-01 US disclosed
EP-1813946-B1 BIOMATERIAL STRUCTURE, METHOD OF PRODUCING THE SAME AND USES THEREOF MITSUBISHI CHEM CORP (JP) 2012-01-25 EP disclosed
EP-2339342-A2 Biomaterial structure, method of producing the same and uses thereof MITSUBISHI CHEMICAL CORPORATION (JP) 2011-06-29 EP disclosed
US-20080044925-A1 Biomaterial Construct, Its Producing Method, Biomaterial Support, Target Material Purifying Method, Affinity Chromatography Container, Separation Chip, Analyzing Method and Analyzing Separator for Target Material, Biomaterial Complex, and Its Support, Sensor Chip, Solid Support with Biomaterial Fixed Thereon LSI MEDIENCE CORPORATION (JP) 2008-02-21 US disclosed
EP-1813946-A1 BIOMATERIAL CONSTRUCT, ITS PRODUCING METHOD, BIOMATERIAL SUPPORT, TARGET MATERIAL PURIFYING METHOD, AFFINITY CHROMATOGRAPHY CONTAINER, SEPARATION CHIP, ANALYZING METHOD AND ANALYZING SEPARATOR FOR TARGET MATERIAL, BIOMATERIAL COMPLEX, AND ITS SUPPORT, SENSOR CHIP, SOLID SUPPORT WITH BIOMATERIAL FIXE Mitsubishi Chemical Corporation (JP) 2007-08-01 EP disclosed