SCHEMBL72654

SCHEMBL72654

C[CH]OC(=O)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.58
LMNA P02545 2/20 0.56
F2 P00734 1/20 0.56
ALDH1A1 P00352 6/20 0.48
TDP1 Q9NUW8 5/20 0.48
HSD17B10 Q99714 1/20 0.48
TP53 P04637 1/20 0.47
PLA2G7 Q13093 1/20 0.46
KMT2A Q03164 4/20 0.45
MAPT P10636 3/20 0.45
MAPK1 P28482 2/20 0.45
HIF1A Q16665 1/20 0.45
POLB P06746 1/20 0.45
SLC6A2 P23975 1/20 0.45
SLC6A3 Q01959 1/20 0.45
CES2 O00748 2/20 0.44
CES1 P23141 2/20 0.44
DAO P14920 1/20 0.44
NAPRT Q6XQN6 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL628707 0.83 TSHR (0.54) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL23945318 0.83 TSHR (0.54) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL2434823 0.83 TSHR (0.54) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL11229507 0.81 LMNA (0.61) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL28182671 0.81 LMNA (0.61) TSHRLMNAF2ALDH1A1TDP1
Benzoic Acid Vinyl Ester SCHEMBL28153430 0.81 TSHR (0.52) TSHRLMNAF2ALDH1A1TDP1
SCHEMBL2721321 0.80 TDP1 (0.59) LMNAALDH1A1TDP1KMT2AMAPT
SCHEMBL28748274 0.80 CA1 (0.59) TSHRLMNAALDH1A1TDP1HSD17B10
Benzoic Acid Vinyl Ester SCHEMBL28299446 0.79 TSHR (0.50) TSHRLMNAF2ALDH1A1TDP1
Benzene SCHEMBL28103328 0.79 LMNA (0.58) TSHRLMNAF2ALDH1A1TDP1

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

Appears in 2522 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3749739-B1 DETERGENT COMPOSITION HAVING A FLOW LIMIT HENKEL AG & CO KGAA (DE) 2023-06-21 EP claimed
EP-3749739-A1 DETERGENT COMPOSITION HAVING A FLOW LIMIT Henkel AG & Co. KGaA (DE) 2020-12-16 EP claimed
EP-3749738-A1 VISCOELASTIC, SOLID SURFACTANT COMPOSITION Henkel AG & Co. KGaA (DE) 2020-12-16 EP claimed
EP-3007738-B1 IMPLANTABLE MATERIAL GRAFTED WITH A CELL ANTIPROLIFERATIVE AND/OR ANTIBACTERIAL FILM SYNTHETIZED FROM A BIFUNCTIONAL MOLECULE BIOWINTECH (FR) 2020-11-25 EP claimed
WO-2019233789-A1 DETERGENT COMPOSITION WITH A YIELD POINT HENKEL AG & CO. KGAA (DE) 2019-12-12 WO claimed
WO-2019154613-A1 DETERGENT COMPOSITION HAVING A FLOW LIMIT HENKEL AG & CO. KGAA (DE) 2019-08-15 WO claimed
WO-2019154612-A1 VISCOELASTIC, SOLID SURFACTANT COMPOSITION HENKEL AG & CO. KGAA (DE) 2019-08-15 WO claimed
US-9925191-B2 Fumarate compounds, pharmaceutical compositions thereof, and methods of use Nguyen, Mark Quang (US) 2018-03-27 US claimed
US-9630934-B2 Fumarate compounds, pharmaceutical compositions thereof, and methods of use Nguyen, Mark Quang (US) 2017-04-25 US claimed
US-20160297770-A1 FUMARATE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USE NGUYEN MARK QUANG (US) 2016-10-13 US claimed
US-4340543-A ANTICANCER AGENTS, ANTITUMOR AGENTS, IMMUNOSTIMULANTS TAIHO PHARMACEUTICAL COMPANY LIMITED (JP) 1982-07-20 US claimed
US-4315855-A Monoazo disperse dyes containing a nitrophenyl group and a homophthalimide group BASF AKTIENGESELLSCHAFT (DE) 1982-02-16 US claimed
US-4289693-A TEXTILES SANDOZ LTD. (CH) 1981-09-15 US claimed
US-4264494-A Chromium complex dyestuffs for natural polyamides and synthetic nylons BASF AKTIENGESELLSCHAFT (DE) 1981-04-28 US claimed
US-4212801-A Unsymmetrical 1:2-chromium complexes containing an azo and an azomethine bond BASF AKTIENGESELLSCHAFT (DE) 1980-07-15 US claimed
US-4198416-A 5-Alkoxy-picolinic esters and anti-hypertensive composition containing 5-alkoxy-picolinic esters MEIJI SEIKA KAISHA, LTD. (JP) 1980-04-15 US claimed
US-4175185-A ESTERIFICATION, IMINOHALOGENATION, ETHERIFICATION, HYDROLYSIS, DEESTERIFICATION MEIJI SEIKA KAISHA LTD. (JP) 1979-11-20 US claimed
US-4107164-A ANTIBIOTICS, ANTIBACTERIAL SANDOZ LTD. (CH) 1978-08-15 US claimed
US-4061616-A PHOTO- AND THERMAL DEGRADATION, OCTAMETHYL-4,4'-DIHYDROXY-BIPIPERIDYLS SANKYO COMPANY LIMITED (JA) 1977-12-06 US claimed
US-4031215-A STREPTOMYCES, ALDOL CONDENSATION KAKEN CHEMICAL CO., LTD. (JA) 1977-06-21 US claimed