SCHEMBL1051782

SCHEMBL1051782

C=CC(=O)OC(C)(C)C#N

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.34
ALDH1A1 P00352 5/20 0.33
TP53 P04637 3/20 0.33
HIF1A Q16665 3/20 0.33
CYP3A4 P08684 2/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL22563763 0.84 TSHR (0.35) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL20420811 0.82 TSHR (0.34) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL1253574 0.80 ELANE (0.40) TSHRALDH1A1TP53HIF1ACYP3A4
Acrylonitrile SCHEMBL27634495 0.78 TSHR (0.38) TSHRALDH1A1TP53HIF1ACYP3A4
Water SCHEMBL27303949 0.78 TSHR (0.38) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL14351740 0.78
SCHEMBL10936362 0.77 TSHR (0.31) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL21381434 0.77 TSHR (0.31) TSHRALDH1A1TP53HIF1ACYP3A4
SCHEMBL30658 0.75
SCHEMBL8965554 0.75 TSHR (0.39) TSHRALDH1A1TP53HIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114585656-B Method and system for preparing high molecular weight ethylene-based polymers 埃克森美孚化学专利公司 2024-03-05 CN claimed
EP-4051717-A1 METHODS AND SYSTEMS FOR THE PRODUCTION OF HIGH MOLECULAR WEIGHT ETHYLENE-BASED POLYMERS ExxonMobil Chemical Patents Inc. (US) 2022-09-07 EP claimed
CN-114585656-A Process and system for preparing high molecular weight ethylene-based polymers 埃克森美孚化学专利公司 2022-06-03 CN claimed
US-11292857-B2 Methods and systems for the production of high molecular weight ethylene-based polymers EXXONMOBIL CHEMICAL PATENTS INC. (US) 2022-04-05 US claimed
US-20210130514-A1 Methods And Systems For The Production Of High Molecular Weight Ethylene-Based Polymers EXXONMOBIL CHEMICAL PATENTS INC (US) 2021-05-06 US claimed
WO-2021086493-A1 METHODS AND SYSTEMS FOR THE PRODUCTION OF HIGH MOLECULAR WEIGHT ETHYLENE-BASED POLYMERS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2021-05-06 WO claimed
WO-2024137203-A1 INITIATOR INJECTION LINE FOR HIGH PRESSURE POLYMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2024-06-27 WO disclosed
WO-2024137201-A1 A TUBULAR REACTOR COMPRISING A THERMOCOUPLE DEVICE FOR MEASURING A TEMPERATURE WITHIN THE TUBULAR REACTOR EXXONMOBIL CHEMICAL PATENTS INC. (US) 2024-06-27 WO disclosed
EP-4389775-A1 INITIATOR INJECTION LINE FOR HIGH PRESSURE POLYMERIZATION ExxonMobil Chemical Patents Inc. (US) 2024-06-26 EP disclosed
EP-4389273-A1 A TUBULAR REACTOR COMPRISING A THERMOCOUPLE DEVICE FOR MEASURING A TEMPERATURE WITHIN THE TUBULAR REACTOR ExxonMobil Chemical Patents Inc. (US) 2024-06-26 EP disclosed
EP-3487924-B1 ROTOMOLDED COMPOSITIONS, ARTICLES, AND PROCESSES FOR MAKING THE SAME EXXONMOBIL CHEMICAL PATENTS INC (US) 2024-06-12 EP disclosed
CN-114585656-B Method and system for preparing high molecular weight ethylene-based polymers 埃克森美孚化学专利公司 2024-03-05 CN disclosed
WO-2023094549-A1 FLEXIBLE PRESSURE-SENSITIVE ADHESIVES HAVING IMPROVED PROPERTIES WESTFÄLISCHE HOCHSCHULE GELSENKIRCHEN BOCHOLT RECKLINGHAUSEN (DE) 2023-06-01 WO disclosed
WO-2004108271-A1 TUBULAR POLYMERIZATION REACTORS AND POLYMERIZATION PROCESS USING SAME EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-16 WO disclosed
US-20040247493-A1 TUBULAR POLYMERIZATION REACTORS AND POLYMERS MADE THEREIN EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-09 US disclosed
US-6673878-B2 Tubular polymerization reactors and polymers made therein EXXONMOBIL CHEMICAL PATENTS INC. 2004-01-06 US disclosed
US-20030206835-A1 TUBULAR POLYMERIZATION REACTORS AND POLYMERS MADE THEREIN EXXONMOBIL CHEMICAL PATENTS INC. 2003-11-06 US disclosed
US-6596241-B2 Tubular polymerization reactors and polymers made therein EXXONMOBIL CHEMICAL PATENTS INC 2003-07-22 US disclosed
US-20030114607-A1 TUBULAR POLYMERIZATION REACTORS AND POLYMERS MADE THEREIN EXXONMOBIL CHEMICAL PATENTS INC. 2003-06-19 US disclosed
US-4156034-A COPOLYMER OF ACRYLIC ESTER AND STYRENE DERIVATIVE AS COATING AGENT HITACHI, LTD. (JP) 1979-05-22 US disclosed