Butadiene

Butadiene

SCHEMBL3389123

C=CC=C.C=Cc1ccccc1C=C

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.57
TSHR P16473 2/20 0.45
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
THRB P10828 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NFE2L2 Q16236 1/20 0.35
HDAC8 Q9BY41 1/20 0.33
TRIM24 O15164 1/20 0.32
TRIM33 Q9UPN9 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.31
SIRT1 Q96EB6 1/20 0.31
GSR P00390 1/20 0.31
AKT1 P31749 1/20 0.31
SLC9A1 P19634 1/20 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
Benzene SCHEMBL1448798 0.97 ALDH1A1 (0.55) ALDH1A1TSHRMEN1LMNATHRB
SCHEMBL7638 0.93 ALDH1A1 (0.63) ALDH1A1TSHRMEN1LMNATHRB
SCHEMBL29405187 0.93 ALDH1A1 (0.63) ALDH1A1TSHRMEN1LMNATHRB
SCHEMBL473080 0.93 ALDH1A1 (0.63) ALDH1A1TSHRMEN1LMNATHRB
Naphthalene SCHEMBL9856642 0.91 ALDH1A1 (0.50) ALDH1A1TSHRMEN1LMNATHRB
SCHEMBL9562250 0.90 ALDH1A1 (0.60) ALDH1A1TSHRMEN1LMNATHRB
SCHEMBL1176773 0.90 ALDH1A1 (0.60) ALDH1A1TSHRMEN1LMNATHRB
SCHEMBL22496001 0.90 ALDH1A1 (0.60) ALDH1A1TSHRMEN1LMNATHRB
SCHEMBL8719955 0.90 ALDH1A1 (0.60) ALDH1A1TSHRMEN1LMNATHRB
Water SCHEMBL20379011 0.90 ALDH1A1 (0.60) ALDH1A1TSHRMEN1LMNATHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114773528-A Vinyl styrene-butadiene latex and preparation method and application thereof 山东京博中聚新材料有限公司 2022-07-22 CN claimed
US-20160244471-A1 PHENOXYCYCLOTRIPHOSPHAZENE ACTIVE ESTER, HALOGEN-FREE RESIN COMPOSITION AND USES THEREOF SHENGYI TECHNOLOGY CO., LTD. (CN) 2016-08-25 US claimed
EP-3037475-A1 PHENOXY CYCLOTRIPHOSPHAZENE ACTIVE ESTER, HALOGEN-FREE RESIN COMPOSITION AND USE THEREOF Shengyi Technology Co., Ltd. (CN) 2016-06-29 EP claimed
EP-2964706-A1 THREADED TUBULAR COMPONENT PROTECTED BY A FILM VALLOUREC OIL AND GAS FRANCE (FR) 2016-01-13 EP claimed
US-20160002476-A1 THREADED TUBULAR COMPONENT PROTECTED BY A FILM VALLOUREC OIL AND GAS FRANCE (FR) 2016-01-07 US claimed
WO-2014135499-A1 THREADED TUBULAR COMPONENT PROTECTED BY A FILM VALLOUREC OIL AND GAS FRANCE (FR) 2014-09-12 WO claimed
US-6245861-B1 CONTROLLING CONCENTRATION HERCULES INCORPORATED 2001-06-12 US claimed
US-6080809-A DECREASING STRAIN MODULUS WITHOUT DECREASING HARDNESS IN SILICA TREAD COMPOUNDS IN RUBBER TIRES BRIDGESTONE/FIRESTONE, INC. (US) 2000-06-27 US claimed
US-5880204-A COATING COMPOSITION COMPRISING AQUEOUS DISPERSION OF PARTICLES COMPRISING SEMI-CRYSTALLINE FIRST COPOLYMER ENVELOPED BY AMORPHOUS SECOND COPOLYMER ALLIEDSIGNAL INC. (US) 1999-03-09 US claimed
CN-111718453-B Partially hydrogenated styrene-b-butadiene-divinylbenzene/isoprene random copolymer, and preparation and application thereof 中国石油化工股份有限公司 2024-03-08 CN disclosed
US-11525049-B2 Polar additive for the synthesis of copolymers of vinylaromatic monomer and conjugated diene monomer having high vinylaromatic and low vinyl contents SYNTHOS S.A. (PL) 2022-12-13 US disclosed
EP-3601389-B1 POLAR ADDITIVE FOR THE SYNTHESIS OF COPOLYMERS OF VINYLAROMATIC MONOMER AND CONJUGATED DIENE MONOMER HAVING HIGH VINYLAROMATIC AND LOW VINYL CONTENTS Synthos Sa (PL) 2021-11-17 EP disclosed
CN-111892669-A Hydrogenated amino functionalized styrene-butadiene rubber and preparation method thereof 沈阳化工研究院有限公司 2020-11-06 CN disclosed
CN-111718453-A Partially hydrogenated styrene-b-butadiene-divinylbenzene/isoprene random copolymer and preparation and application thereof 中国石油化工股份有限公司 2020-09-29 CN disclosed
US-4791151-A Multilobals ROHM AND HAAS COMPANY (US) 1988-12-13 US disclosed
US-4761442-A CHELATE COMPOUNDS, ACID ACTIVATORS, FILM FORMING POLYMERS SFS STADLER HEERBRUGG AG (CH) 1988-08-02 US disclosed
US-4753986-A BLEND WITH SHELL-CORE POLYMER GENERAL ELECTRIC COMPANY (US) 1988-06-28 US disclosed
US-4399260-A CONJUGATED POLYENE, POLYVINYLAROMATIC COUPLER, LITHIUM-CAPPED STYRENE POLYMER, POLR COMPOUND THE GOODYEAR TIRE & RUBBER COMPANY (US) 1983-08-16 US disclosed
EP-0083576-A2 Increasing the reactivity of coupling of block polymers THE GOODYEAR TIRE & RUBBER COMPANY (US) 1983-07-13 EP disclosed
US-4254004-A USING INITIALLY FORMED ADDITION POLYMER PARTICLES TO SEED THE POLYMERIZATION OF UNSATURATED MONOMERS SCM CORPORATION (US) 1981-03-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160244471-A1 PHENOXYCYCLOTRIPHOSPHAZENE ACTIVE ESTER, HALOGEN-FREE RESIN COMPOSITION AND USES THEREOF PFAS, PGLS, ELL ALDH1A1 2788/4885TSHR 2806/4885MEN1 4854/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.