SCHEMBL1156726

SCHEMBL1156726

[O]C(=O)CCc1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.70
FFAR1 O14842 2/20 0.64
ALDH1A1 P00352 2/20 0.64
HDAC2 Q92769 3/20 0.59
HDAC8 Q9BY41 3/20 0.59
HDAC6 Q9UBN7 3/20 0.59
TDP1 Q9NUW8 3/20 0.59
HDAC1 Q13547 5/20 0.58
HDAC3 O15379 2/20 0.58
HDAC4 P56524 2/20 0.58
HDAC7 Q8WUI4 2/20 0.58
HDAC10 Q969S8 2/20 0.58
HDAC11 Q96DB2 2/20 0.58
HDAC9 Q9UKV0 2/20 0.58
HDAC5 Q9UQL6 2/20 0.58
MAPK1 P28482 1/20 0.58
ADRA1A P35348 1/20 0.58
SLC6A3 Q01959 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
MAPT P10636 3/20 0.55

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
SCHEMBL3879501 0.86 HDAC1 (0.72) KEAP1FFAR1ALDH1A1HDAC2HDAC8
SCHEMBL2259695 0.84 MAPT (0.70) KEAP1HDAC2HDAC8HDAC6TDP1
SCHEMBL10012805 0.82 MAPT (0.74) HDAC2HDAC8HDAC6TDP1HDAC1
SCHEMBL10906659 0.82 MAPT (0.74) HDAC2HDAC8HDAC6TDP1HDAC1
SCHEMBL9129063 0.82 MAPT (0.74) HDAC2HDAC8HDAC6TDP1HDAC1
SCHEMBL10011031 0.82 MAPT (0.74) HDAC2HDAC8HDAC6TDP1HDAC1
SCHEMBL10906647 0.82 MAPT (0.74) HDAC2HDAC8HDAC6TDP1HDAC1
SCHEMBL10907431 0.82 MAPT (0.74) HDAC2HDAC8HDAC6TDP1HDAC1
SCHEMBL10790046 0.82 MAPT (0.74) HDAC2HDAC8HDAC6TDP1HDAC1
SCHEMBL497371 0.82 KEAP1 (0.73) KEAP1FFAR1ALDH1A1HDAC2HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114377006-A Absorption enhancer for cinnamic acid derivatives 株式会社山田养蜂场本社 2022-04-22 CN claimed
CN-111965941-A Positive photosensitive polyimide resin composition and use thereof 浙江福斯特新材料研究院有限公司 2020-11-20 CN claimed
CN-1393438-B Taxane derivative and its preparing process and usage Inst of Medical Materials Chinese Academy of Medical Sciences 2010-11-03 CN claimed
CN-100415770-C 2-{[N-(2-amino-3-(heteroaryl or aryl) propionyl)-aminoacyl]-amino}- alkylboronic acid derivatives NOVARTIS AG (CH) 2008-09-03 CN claimed
US-7388003-B2 Δ15-D-Homosteroids with androgenic action BAYER SCHERING PHARMA AG (DE) 2008-06-17 US claimed
CN-1997659-A D-carb-17-chloro-16 -ene steroids SCHERING AG (DE) 2007-07-11 CN claimed
WO-2006138589-A2 OPIOID RECEPTOR LIGANDS UNIVERSITY OF IOWA RESEARCH FOUNDATION (US) 2006-12-28 WO claimed
EP-1322660-B1 17ALPHA-FLUOROALKYL STEROIDS, METHOD FOR PRODUCING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAID COMPOUNDS SCHERING AG (DE) 2006-08-30 EP claimed
EP-1399468-B1 2-((N-(2-AMINO-3-(HETEROARYL OR ARYL)PROPIONYL)-AMINOACYL)-AMINO)-ALKYLBORONIC ACID DERIVATIVES NOVARTIS AG (CH) 2006-02-15 EP claimed
US-20050234111-A1 D-homo-17-chlor-16(17)-ene steroids BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2005-10-20 US claimed
US-5763438-A ANTIVIRAL AGENTS SEIKAGAKU CORPORATION (JP) 1998-06-09 US claimed
WO-1997019060-A1 3-(4-SUBST.-PIPERIDINYL-1)-1-(3,4-DICHLOROPHENYL)PROPYL CARBAMATES AND UREAS AND DERIVATIVES AS NOVEL NEUROKININ ANTAGONISTS ZENECA LIMITED (GB) 1997-05-29 WO claimed
US-5358939-A For applying to soils, seeds, plants, or for storage of cereal grains ROHM AND HAAS COMPANY (US) 1994-10-25 US claimed
EP-0576201-A2 Fungicidal 1,2,4-triazoles ROHM AND HAAS COMPANY (US) 1993-12-29 EP claimed
US-4959362-A FREE RADICAL SCAVENGERS TAKEDA CHEMICAL INDUSTRIES, INC. (JP) 1990-09-25 US claimed
EP-0124216-B1 C-20- AND C-23-MODIFIED MACROLIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1988-10-26 EP claimed
EP-0124216-A1 C-20- and C-23-modified macrolide derivatives ELI LILLY AND COMPANY (US) 1984-11-07 EP claimed
US-4468511-A C-20- And C-23-Modified macrolide derivatives ELI LILLY AND COMPANY (US) 1984-08-28 US claimed
US-4260551-A ALIPHATIC OR AROMATIC ESTERS, ANTIULCER AGENTS SANKYO COMPANY LIMITED (JP) 1981-04-07 US claimed
US-4089865-A Certain thiazole compounds SYNTEX (U.S.A.) INC. (US) 1978-05-16 US claimed

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

For each of this compound's patents that has machine-readable text (1 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-20050234111-A1 D-homo-17-chlor-16(17)-ene steroids CYP17A1, HSD17B11, HSD17B7 KEAP1 2164/4885FFAR1 1891/4885ALDH1A1 611/4885

“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.