SCHEMBL8046342

SCHEMBL8046342

C=C(Cc1ccccc1)OC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
CES1 P23141 2/20 0.48
CES2 O00748 1/20 0.48
AKR1B1 P15121 1/20 0.48
TSHR P16473 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.44
MAPK1 P28482 1/20 0.44
GAA P10253 1/20 0.44
KDM4E B2RXH2 3/20 0.44
LMNA P02545 1/20 0.44
PAM P19021 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
KEAP1 Q14145 1/20 0.41

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
SCHEMBL16966556 0.85 CES1 (0.45) ALDH1A1CES1CES2AKR1B1TSHR
SCHEMBL14775421 0.84 CES1 (0.52) ALDH1A1CES1CES2AKR1B1TSHR
SCHEMBL14775420 0.84 CES1 (0.52) ALDH1A1CES1CES2AKR1B1TSHR
SCHEMBL217133 0.83 CES1 (0.48) ALDH1A1CES1CES2AKR1B1TSHR
SCHEMBL7025625 0.83 ALDH1A1 (0.60) ALDH1A1L3MBTL1MAPK1KDM4EKMT2A
Phenylacetic Acid SCHEMBL28239335 0.80 AKR1B1 (0.71) ALDH1A1CES1CES2AKR1B1TSHR
SCHEMBL248114 0.80 TSHR (0.58) ALDH1A1CES1CES2AKR1B1TSHR
SCHEMBL6551294 0.79 TDP1 (0.52) ALDH1A1CES1CES2AKR1B1TSHR
Ethane SCHEMBL10952941 0.78 TSHR (0.56) ALDH1A1CES1CES2AKR1B1TSHR
Acetic Acid SCHEMBL28845782 0.78 TSHR (0.56) ALDH1A1CES1CES2AKR1B1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106062068-B Thermoplastic composition based on polypropylene and polyamide-grafted polyolefin 阿肯马法国公司 2020-11-27 CN disclosed
CN-105308100-B Nanostructured thermoplastic composition of the polyamide-grafted polymer type 阿肯马法国公司 2019-12-17 CN disclosed
US-9978897-B2 Thermoplastic composition, in particular for photovoltaic modules ARKEMA FRANCE (FR) 2018-05-22 US disclosed
US-20160247953-A1 THERMOPLASTIC COMPOSITION, IN PARTICULAR FOR PHOTOVOLTAIC MODULES ARKEMA FRANCE (FR) 2016-08-25 US disclosed
EP-0679649-B1 2,3-Dihydrobenzofuran Derivatives ASAHI CHEMICAL IND (JP) 2000-04-26 EP disclosed
US-5798382-A TREATING SEROTONERGIC NEURON-RELATED DISEASES ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1998-08-25 US disclosed
US-5792791-A FOR PREVENTION AND TREATMENT OF SEROTONERGIC NEURON-RELATED DISEASES; HYPOTENSIVE AGENTS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1998-08-11 US disclosed
EP-0769496-A1 NOVEL 2,3-DIHYDROBENZOFURAN DERIVATIVE, PROCESS FOR PRODUCING THE SAME, AND USE THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1997-04-23 EP disclosed
EP-0679649-A1 2,3-DIHYDROBENZOFURAN DERIVATIVE Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1995-11-02 EP disclosed
US-4388451-A EPOXY CURATIVES, ION EXCHANGE MEMBRANES, LAMINATES, DETERGENT ADDITIVES ASHLAND OIL, INC. (US) 1983-06-14 US disclosed