SCHEMBL11650545

SCHEMBL11650545

CC(C)CC(=O)c1ccccc1Cl

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERCC5 P28715 1/20 0.53
FEN1 P39748 1/20 0.53
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
ALDH1A1 P00352 4/20 0.50
RECQL P46063 1/20 0.49
RAB9A P51151 3/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
NPC1 O15118 1/20 0.47
KDM4E B2RXH2 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 2/20 0.47
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
CXCR3 P49682 1/20 0.44
GPR139 Q6DWJ6 1/20 0.44
HPGD P15428 1/20 0.44
TP53 P04637 1/20 0.44
ADRB2 P07550 1/20 0.43

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
SCHEMBL12237061 0.80 ERCC5 (0.45) ERCC5FEN1CES2CES1ALDH1A1
SCHEMBL19984929 0.79 ERCC5 (0.51) ERCC5FEN1CES2CES1ALDH1A1
SCHEMBL27925176 0.78 FFAR1 (0.48) ALDH1A1RAB9AMEN1KMT2ANPC1
SCHEMBL13647199 0.78 ERCC5 (0.55) ERCC5FEN1ALDH1A1RAB9AMEN1
SCHEMBL8635130 0.78 ALDH1A1 (0.44) ALDH1A1RAB9AKDM4ELMNASMN1; SMN2
SCHEMBL13257558 0.78 ALDH1A1 (0.56) ALDH1A1KDM4EMAPTSMN1; SMN2HPGD
SCHEMBL30173802 0.78 ALDH1A1 (0.62) ERCC5FEN1ALDH1A1RECQLRAB9A
SCHEMBL2258001 0.78 ALDH1A1 (0.62) ERCC5FEN1ALDH1A1RECQLRAB9A
SCHEMBL2837238 0.78 ERCC5 (0.58) ERCC5FEN1CES2CES1ALDH1A1
SCHEMBL15979733 0.77 CES2 (0.62) ERCC5FEN1CES2CES1ALDH1A1

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 36 patents — showing the first 20. 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-20180312887-A1 MICROBIAL PRODUCTION OF CHEMICAL PRODUCTS AND RELATED COMPOSITIONS, METHODS AND SYSTEMS CARGILL INC (US) 2018-11-01 US disclosed
US-20180312886-A1 MICROBIAL PRODUCTION OF CHEMICAL PRODUCTS AND RELATED COMPOSITIONS, METHODS AND SYSTEMS CARGILL INC (US) 2018-11-01 US disclosed
US-20090192129-A1 BICYCLIC PYRROLE DERIVATIVES DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-07-30 US disclosed
US-20090149483-A1 BICYCLIC PYRROLE DERIVATIVES DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2009-06-11 US disclosed
US-20080318922-A1 Bicyclic Pyrrole Derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-12-25 US disclosed
EP-1829877-A1 BICYCLIC PYRROLE DERIVATIVES Dainippon Sumitomo Pharma Co., Ltd. (JP) 2007-09-05 EP disclosed
US-20070105890-A1 Novel condensed imidazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD 2007-05-10 US disclosed
US-20070082908-A1 Bicycle pyrazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-12 US disclosed
US-20070082908-A1 Bicycle pyrazole derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-12 US disclosed
US-4101585-A PRENYLATION OF ACYLPHLOROGLUCINOLS CIBA-GEIGY CORPORATION (US) 1978-07-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070105890-A1 Novel condensed imidazole derivative DPP4, DPP7, DPP3 ERCC5 4609/4885FEN1 3647/4885CES2 432/4885
US-20080318922-A1 Bicyclic Pyrrole Derivatives DPP4, DPP7, DPP3 ERCC5 4576/4885FEN1 2504/4885CES2 127/4885
US-20090192129-A1 BICYCLIC PYRROLE DERIVATIVES DPP4, DPP7, DPP3 ERCC5 4672/4885FEN1 2384/4885CES2 170/4885
US-20090149483-A1 BICYCLIC PYRROLE DERIVATIVES DPP4, DPP7, DPP3 ERCC5 4672/4885FEN1 2384/4885CES2 170/4885
US-20070082908-A1 Bicycle pyrazole derivative DPP4, DPP7, DPP3 ERCC5 4293/4885FEN1 3989/4885CES2 436/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.