SCHEMBL6063406

SCHEMBL6063406

C=C(O)C(=O)OCC(C)C

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.68
ALDH1A1 P00352 7/20 0.41
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
P2RX4 Q99571 1/20 0.33
KDM4E B2RXH2 2/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 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
SCHEMBL20403117 0.84 TSHR (0.48) TSHRMAPTMAPK1HSD17B10
SCHEMBL20262429 0.83 TSHR (0.71) TSHRALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL298254 0.82 TSHR (0.68) TSHRALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL24562 0.81 TSHR (1.00) TSHRALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL7678018 0.81 TSHR (0.68) TSHRALDH1A1RAB9ASMN1; SMN2HPGD
Methacrylic Acid SCHEMBL1472434 0.80 TSHR (0.88) TSHRALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL5314281 0.80 TSHR (0.60) TSHRALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL23909439 0.79 TSHR (0.65) TSHRALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL6757078 0.79 TSHR (0.65) TSHRALDH1A1RAB9ASMN1; SMN2HPGD
SCHEMBL9082422 0.79 TSHR (0.95) TSHRALDH1A1RAB9ASMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4529777-A Crosslinking DAIDONE PHILIP 1985-07-16 US claimed
US-10479851-B2 Preparation of N-vinyl carboxamides in a series of reactor units BASE SE (DE) 2019-11-19 US disclosed
WO-2018160696-A1 ANALYTE SENSORS AND METHODS OF MANUFACTURING ANALYTE SENSORS METRONOM HEALTH, INC. (US) 2018-09-07 WO disclosed
US-20180208691-A1 PREPARATION OF N-VINYL CARBOXAMIDES IN A SERIES OF REACTOR UNITS BASF SE (DE) 2018-07-26 US disclosed
EP-3325521-A1 PREPARATION OF N-VINYL CARBOXAMIDES IN SERIES OF REACTOR UNITS BASF SE (DE) 2018-05-30 EP disclosed
WO-2017017559-A1 PREPARATION OF N-VINYL CARBOXAMIDES IN SERIES OF REACTOR UNITS BASF SE (DE) 2017-02-02 WO disclosed
EP-1712599-A1 Coating composition comprising an unsaturated hydroxydiester with superior outdoor durability Hexion Specialty Chemicals Research Belgium S.A. (BE) 2006-10-18 EP disclosed
WO-2005040241-A1 FAST DRYING COATING COMPOSITION COMPRISING AN UNSATURATED HYDROXYDIESTER HEXION SPECIALTY CHEMICALS RESEARCH BELGIUM S.A. (BE) 2005-05-06 WO disclosed
EP-1524280-A1 Fast drying coating composition comprising an unsaturated hydroxydiester Resolution Research Belgium S.A. (BE) 2005-04-20 EP disclosed
WO-2003011923-A1 COPOLYMERS FOR COATING COMPOSITIONS RESOLUTION RESEARCH NEDERLAND B.V. (NL) 2003-02-13 WO disclosed
EP-1283226-A1 Hydroxyl-functional copolymer and coating compositions formed therewith Resolution Research Nederland B.V. (NL) 2003-02-12 EP disclosed
US-5973094-A Functional polymers WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 1999-10-26 US disclosed
EP-0595286-B1 Organic solvent dispersible polyamide modified resins for use in coating compositions BASF CORP (US) 1999-05-06 EP disclosed
EP-0794199-A2 Novel functional polymers WAKO PURE CHEMICAL INDUSTRIES, LTD (JP) 1997-09-10 EP disclosed