SCHEMBL1048103

SCHEMBL1048103

C=C(CO)C(=O)OCC(CC)CCCC

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.58
CYP3A4 P08684 5/20 0.57
TDP1 Q9NUW8 2/20 0.57
ATM Q13315 1/20 0.57
ALDH1A1 P00352 7/20 0.50
CA2 P00918 4/20 0.50
RECQL P46063 1/20 0.48
LMNA P02545 3/20 0.46
MAPK1 P28482 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PRSS1 P07477 1/20 0.44
PRSS2 P07478 1/20 0.44
PRSS3 P35030 1/20 0.44
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP14 P50281 1/20 0.40
CA1 P00915 1/20 0.39

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
SCHEMBL16412767 0.89 TSHR (0.59) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL22442109 0.87 CYP3A4 (0.61) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL28894126 0.87 CYP3A4 (0.61) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL5013183 0.87 TSHR (0.58) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL1520776 0.86 TSHR (0.56) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL5444856 0.86 TSHR (0.56) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL6657558 0.85 TSHR (0.63) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL23706500 0.84 TSHR (0.62) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL8204738 0.84 TSHR (0.62) TSHRCYP3A4TDP1ATMALDH1A1
SCHEMBL227554 0.84 CYP3A4 (0.62) TSHRCYP3A4TDP1ATMALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1159318-B1 OLIGOMERIZATION AND (CO)POLYMERIZATION OF SUBSTITUTED AND UNSUBSTITUTED ALPHA-METHYLENE-GAMMA-BUTYROLACTONES AND PRODUCTS THEREOF DU PONT (US) 2004-01-21 EP claimed
EP-0738703-B1 Acrylic acid derivatives, method for preparing the acrylic acid derivatives, and acrylic acid polymers NIPPON CATALYTIC CHEM IND (JP) 2002-05-22 EP claimed
US-6388036-B1 USING FREE RADICAL CATALYST AND CHAIN TRANSFER AGENT; MOLECULAR WEIGHT CONTROL E. I. DU PONT DE NEMOURS AND COMPANY 2002-05-14 US claimed
EP-1159318-A2 OLIGOMERIZATION AND (CO)POLYMERIZATION OF SUBSTITUTED AND UNSUBSTITUTED ALPHA-METHYLENE-GAMMA-BUTYROLACTONES AND PRODUCTS THEREOF E.I. DUPONT DE NEMOURS AND COMPANY (US) 2001-12-05 EP claimed
WO-2000035960-A2 OLIGOMERIZATION, POLYMERIZATION AND COPOLYMERIZATION OF SUBSTITUTED AND UNSUBSTITUTED α-METHYLENE-η-BUTYROLACTONES AND PRODUCTS THEREOF E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-06-22 WO claimed
EP-1003793-A1 FUNCTIONALIZED DIENE OLIGOMERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 2000-05-31 EP claimed
WO-1999009077-A1 FUNCTIONALIZED DIENE OLIGOMERS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1999-02-25 WO claimed
US-5847060-A Functionalized diene oligomers E. I. DU PONT DE NEMOURS AND COMPANY (US) 1998-12-08 US claimed
US-5834576-A CROSSLINKING USING AN ACRYLIC ESTER CONTAINING ETHER GROUPS NIPPON SHOKUBAI CO., LTD. (JP) 1998-11-10 US claimed
EP-0738703-A2 Acrylic acid derivatives, method for preparing the acrylic acid derivatives, and acrylic acid polymers NIPPON SHOKUBAI CO., LTD. (JP) 1996-10-23 EP claimed
WO-2024024213-A1 THERMOSETTING RESIN COMPOSITION AND MOLDED ARTICLE 株式会社レゾナック 2024-02-01 WO disclosed
CN-116057088-A Copolymer, copolymer solution, photosensitive resin composition, cured product, method for producing copolymer, and method for producing copolymer solution 株式会社日本触媒 2023-05-02 CN disclosed
CN-114341215-A Curable composition 株式会社日本触媒 2022-04-12 CN disclosed
CN-111542554-B Polymer, curable resin composition, and use thereof 株式会社日本触媒 2022-03-18 CN disclosed
WO-2021039799-A1 CURABLE COMPOSITION 株式会社日本触媒 2021-03-04 WO disclosed
WO-1997031031-A1 BRANCHED POLYMER SYNTHESIS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1997-08-28 WO disclosed
EP-0755951-A2 Acrylic ester derivative and producing process of the same and acrylic-ester-based polymer NIPPON SHOKUBAI CO., LTD. (JP) 1997-01-29 EP disclosed
EP-0738703-A2 Acrylic acid derivatives, method for preparing the acrylic acid derivatives, and acrylic acid polymers NIPPON SHOKUBAI CO., LTD. (JP) 1996-10-23 EP disclosed
US-4977229-A ACRYLATED SILOXANE; CONTACT LENSES THE UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 1990-12-11 US disclosed
US-4654432-A Preparation of 2-(hydroxymethyl)-acrylonitrile and 2-(hydroxymethyl)-acrylates BASF AKTIENGESELLSCHAFT (DE) 1987-03-31 US disclosed