SCHEMBL502955

SCHEMBL502955

C=C(C=C(C)C(=O)O)C(=O)OCC.C=CC(=O)OCCCC

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.58
HPGD P15428 1/20 0.58
ALDH1A1 P00352 4/20 0.42
CYP3A4 P08684 1/20 0.42
ATM Q13315 1/20 0.41
HCAR2 Q8TDS4 3/20 0.41
TP53 P04637 2/20 0.36
HIF1A Q16665 2/20 0.36
HSD17B10 Q99714 1/20 0.36
THRB P10828 3/20 0.35
NPSR1 Q6W5P4 2/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34

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
Acrylic Acid Ethyl Ester SCHEMBL9336641 0.95 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL16585047 0.91 TSHR (0.48) TSHRHPGDALDH1A1CYP3A4ATM
Acrylic Acid Ethyl Ester SCHEMBL11817856 0.91 TSHR (0.50) TSHRHPGDALDH1A1CYP3A4ATM
Acrylic Acid Ethyl Ester SCHEMBL8607717 0.90 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4ATM
Acrylic Acid Methyl Ester SCHEMBL5490014 0.88 TSHR (0.45) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL11285889 0.88 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4TP53
SCHEMBL9436100 0.86 TSHR (0.54) TSHRHPGDALDH1A1ATMHCAR2
SCHEMBL168598 0.86 TSHR (0.50) TSHRHPGDALDH1A1ATMHCAR2
Acrylic Acid Ethyl Ester SCHEMBL10803408 0.86 TSHR (0.42) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL869486 0.85 TSHR (0.51) TSHRHPGDALDH1A1CYP3A4ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8828360-B2 Hair styling compositions with improved clarity and humidity resistance ROHM AND HAAS COMPANY (US) 2014-09-09 US claimed
EP-2433614-A2 Hair styling compositions with improved clarity and humidity resistance Rohm and Haas Company (US) 2012-03-28 EP claimed
US-20120039819-A1 HAIR STYLING COMPOSITIONS WIYH IMPROVED CLARITY AND HUMIDITY RESISTANCE ROHM AND HAAS COMPANY 2012-02-16 US claimed
US-20230082890-A1 MULTISTAGE POLYMER COMPOSITION AND METHOD OF USE ROHM & HAAS (US) 2023-03-16 US disclosed
WO-2023277075-A1 TOPICAL SKIN AGENT CONTAINING HEPARINOID AND LOXOPROFEN OR SALT THEREOF 第一三共ヘルスケア株式会社 2023-01-05 WO disclosed
EP-2529794-B1 Fixative polymer compatible with hair styling composition ROHM & HAAS (US) 2020-09-09 EP disclosed
US-20170283607-A1 Multistage polymer composition and method of use ROHM & HAAS (US) 2017-10-05 US disclosed
US-9345656-B2 Acrylic polymer DSM IP ASSETS B.V. (NL) 2016-05-24 US disclosed
US-9302126-B2 Fixative polymer compatible with hair styling composition ROHM AND HAAS COMPANY 2016-04-05 US disclosed
US-9249247-B2 Acrylic polymer DSM IP ASSETS B.V. (NL) 2016-02-02 US disclosed
EP-2106784-B1 Hair styling composition ROHM & HAAS (US) 2015-04-22 EP disclosed
US-5516840-A Polymer blends ROHM AND HAAS COMPANY (US) 1996-05-14 US disclosed
EP-0705595-A2 Hair styling compositions ROHM AND HAAS COMPANY (US) 1996-04-10 EP disclosed
US-5504153-A POLYMERS CONTAINING A HIGH PERCENTAGE OF VINYL ALCOHOL UNITS BLENDED WITH COPOLYMERS OF ALKYL METHACRYLATES AND UNSATURATED ORGANIC ACIDS; POSSESS BARRIER AND STRENGTH PROPERTIES FOR PACKAGING ROHM AND HAAS COMPANY (US) 1996-04-02 US disclosed
US-5504154-A VINYL ALCOHOL POLYMER BLENDED WITH COPOLYMERS OF ALKYL METHACRYLATES AND UNSATURATED ORGANIC ACIDS ANHYDRIDED ROHM AND HAAS COMPANY (US) 1996-04-02 US disclosed
EP-0686653-A1 BLOCK POLYMER, THERMOPLASTIC ADDITION POLYMER, PRODUCTION PROCESS, AND USE NIPPON SHOKUBAI CO., LTD. (JP) 1995-12-13 EP disclosed
US-5451635-A Sheets, films, fibers of polyvinyl alcohol, alkyl methacrylate polymers ROHM AND HAAS COMPANY (US) 1995-09-19 US disclosed
US-5389724-A Flexible films; melt processability ROHM AND HAAS COMPANY (US) 1995-02-14 US disclosed
US-5378758-A FOR BONDING PAPER, WOOD AND OTHER CELLULOSE ARTICLES ROHM AND HAAS COMPANY (US) 1995-01-03 US disclosed
US-5378759-A EXHIBITING A USEFUL BALANCE OF BARRIER AND STRENGTH PROPERTIES ROHM AND HAAS COMPANY (US) 1995-01-03 US disclosed