SCHEMBL11650548

SCHEMBL11650548

CC(CCl)CC(=O)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.55
MAPK1 P28482 2/20 0.55
GSK3B P49841 2/20 0.55
TRPA1 O75762 1/20 0.55
HIF1A Q16665 1/20 0.55
TSHR P16473 1/20 0.55
L3MBTL1 Q9Y468 5/20 0.53
MAPT P10636 3/20 0.53
HPGD P15428 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
LMNA P02545 2/20 0.53
KMT2A Q03164 6/20 0.51
MEN1 O00255 5/20 0.50
NPC1 O15118 2/20 0.50
TDP1 Q9NUW8 2/20 0.48
KDM4E B2RXH2 1/20 0.48
CYP3A4 P08684 1/20 0.48
ALOX15 P16050 1/20 0.48
CES1 P23141 1/20 0.48
POLB P06746 1/20 0.47

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
SCHEMBL9225409 0.82 TSHR (0.57) ALDH1A1MAPK1GSK3BTRPA1HIF1A
SCHEMBL96579 0.82 TSHR (0.57) ALDH1A1MAPK1GSK3BTRPA1HIF1A
SCHEMBL12158744 0.82 TSHR (0.57) ALDH1A1MAPK1GSK3BTRPA1HIF1A
SCHEMBL14006544 0.82 TSHR (0.57) ALDH1A1MAPK1GSK3BTRPA1HIF1A
SCHEMBL96580 0.82 TSHR (0.57) ALDH1A1MAPK1GSK3BTRPA1HIF1A
SCHEMBL8845817 0.81 TSHR (0.55) ALDH1A1MAPK1GSK3BTRPA1HIF1A
SCHEMBL4770344 0.81 GSK3B (0.55) ALDH1A1MAPK1GSK3BTRPA1HIF1A
SCHEMBL2598225 0.80 TSHR (0.59) ALDH1A1MAPK1GSK3BTRPA1HIF1A
SCHEMBL9799560 0.79 TSHR (0.63) ALDH1A1MAPK1GSK3BTRPA1HIF1A
SCHEMBL2026026 0.79 TSHR (0.63) ALDH1A1MAPK1GSK3BTRPA1HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024112694-A1 RECOMBINANT POLYPEPTIDES WITH PRENYLTRANSFERASE ACTIVITY FOR BIOSYNTHESIS OF CANNABINOIDS AND HOP COMPOUNDS WILLOW BIOSCIENCES, INC. (CA) 2024-05-30 WO claimed
CN-109415681-A For producing the composition and method of type III polyketone in oleaginous yeast kind 德克萨斯大学系统董事会 2019-03-01 CN claimed
EP-3430124-A1 COMPOSITIONS AND METHODS FOR TYPE III POLYKETIDE PRODUCTION IN OLEAGINOUS YEAST SPECIES Board of Regents, The University of Texas System (US) 2019-01-23 EP claimed
WO-2017160801-A1 COMPOSITIONS AND METHODS FOR TYPE III POLYKETIDE PRODUCTION IN OLEAGINOUS YEAST SPECIES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-09-21 WO claimed
WO-2024112694-A1 RECOMBINANT POLYPEPTIDES WITH PRENYLTRANSFERASE ACTIVITY FOR BIOSYNTHESIS OF CANNABINOIDS AND HOP COMPOUNDS WILLOW BIOSCIENCES, INC. (CA) 2024-05-30 WO disclosed
US-20240043850-A1 COMPOSITIONS AND METHODS FOR TYPE III POLYKETIDE PRODUCTION IN OLEAGINOUS YEAST SPECIES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2024-02-08 US disclosed
US-11820987-B2 Compositions and methods for type III polyketide production in oleaginous yeast species BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2023-11-21 US disclosed
US-20190078098-A1 COMPOSITIONS AND METHODS FOR TYPE III POLYKETIDE PRODUCTION IN OLEAGINOUS YEAST SPECIES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2019-03-14 US disclosed
CN-109415681-A For producing the composition and method of type III polyketone in oleaginous yeast kind 德克萨斯大学系统董事会 2019-03-01 CN disclosed
EP-3430124-A1 COMPOSITIONS AND METHODS FOR TYPE III POLYKETIDE PRODUCTION IN OLEAGINOUS YEAST SPECIES Board of Regents, The University of Texas System (US) 2019-01-23 EP disclosed
US-20180312886-A1 MICROBIAL PRODUCTION OF CHEMICAL PRODUCTS AND RELATED COMPOSITIONS, METHODS AND SYSTEMS CARGILL INC (US) 2018-11-01 US disclosed
US-20180312887-A1 MICROBIAL PRODUCTION OF CHEMICAL PRODUCTS AND RELATED COMPOSITIONS, METHODS AND SYSTEMS CARGILL INC (US) 2018-11-01 US disclosed
WO-2017160801-A1 COMPOSITIONS AND METHODS FOR TYPE III POLYKETIDE PRODUCTION IN OLEAGINOUS YEAST SPECIES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-09-21 WO disclosed
US-20140330032-A1 MICROBIAL PRODUCTION OF CHEMICAL PRODUCTS AND RELATED COMPOSITIONS, METHODS AND SYSTEMS OPX BIOTECHNOLOGIES, INC. 2014-11-06 US disclosed
US-4101585-A PRENYLATION OF ACYLPHLOROGLUCINOLS CIBA-GEIGY CORPORATION (US) 1978-07-18 US disclosed