SCHEMBL58359

SCHEMBL58359

[CH2]CCOCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.64
NAAA Q02083 1/20 0.47
CA1 P00915 4/20 0.47
CA2 P00918 2/20 0.47
CA7 P43166 2/20 0.47
CA9 Q16790 2/20 0.47
IDO1 P14902 1/20 0.46
AGXT P21549 1/20 0.44
LTA4H P09960 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HRH4 Q9H3N8 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42
TACR1 P25103 2/20 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
SCHEMBL9341880 0.96 TSHR (0.58) TSHRNAAACA1CA2CA7
SCHEMBL20305199 0.92 TSHR (0.54) TSHRNAAACA1CA2CA7
SCHEMBL28364886 0.92 TSHR (0.54) TSHRNAAACA1CA2CA7
SCHEMBL58823 0.86 TSHR (0.58) TSHRNAAACA1CA2CA7
SCHEMBL1991359 0.85 TSHR (0.78) TSHRNAAACA1CA2CA7
SCHEMBL57600 0.85 TSHR (0.56) TSHRNAAACA1CA2CA7
SCHEMBL1890425 0.84 TSHR (0.61) TSHRNAAACA1CA2CA7
SCHEMBL2167093 0.83 L3MBTL1 (0.54) TSHRNAAACA1CA2CA7
SCHEMBL2167509 0.83 L3MBTL1 (0.54) TSHRNAAACA1CA2CA7
SCHEMBL2167399 0.83 L3MBTL1 (0.54) TSHRNAAACA1CA2CA7

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 1196 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117567300-A Synthesis method of gamma-amino alcohol containing continuous chiral center 江苏大学 2024-02-20 CN claimed
CN-117164492-A Organic semiconductor g-C 3 N 4 Method for catalytic synthesis of (E) -vinyl selenone compound 化学与精细化工广东省实验室 2023-12-05 CN claimed
CN-112661764-B Tetrahydrofuran indole compound and preparation method and application thereof 温州大学新材料与产业技术研究院 2022-10-28 CN claimed
CN-113004293-A Tetrahydrofuran [2,3-b ] indoline compound and preparation method and application thereof 温州大学新材料与产业技术研究院 2021-06-22 CN claimed
CN-112661764-A Tetrahydrofuran indole compound and preparation method and application thereof 温州大学新材料与产业技术研究院 2021-04-16 CN claimed
CN-107417615-B Novel preparation method of chiral quinolinone derivative promoted by visible light 华中师范大学 2019-12-13 CN claimed
EP-3154961-B1 QUINAZOLINONE DERIVATIVES AS PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS GILEAD SCIENCES INC (US) 2019-10-09 EP claimed
CN-110256757-A A kind of quaternary alkylphosphonium salt composite antibacterial EVA shoe cushion material and preparation method thereof 广州大学 2019-09-20 CN claimed
CN-110003042-A α, α -difluoroallyl aromatic hydrocarbon compound and preparation method thereof 南京工业大学 2019-07-12 CN claimed
US-10308639-B2 Phosphatidylinositol 3-kinase inhibitors GILEAD SCIENCES, INC. (US) 2019-06-04 US claimed
WO-1998030551-A1 MACROCYCLIC INHIBITORS OF MATRIX METALLOPROTEINASES AND TNFα SECRETION ABBOTT LABORATORIES (US) 1998-07-16 WO claimed
CN-1166825-A Metalloproteinase inhibitors BRITISH BIOTECH PHARM (GB) 1997-12-03 CN claimed
EP-0793641-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1997-09-10 EP claimed
WO-1997019053-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1997-05-29 WO claimed
WO-1997003783-A9 METALLOPROTEINASE INHIBITORS 1997-04-03 WO claimed
WO-1997003783-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1997-02-06 WO claimed
WO-1996016931-A1 METALLOPROTEINASE INHIBITORS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-06-06 WO claimed
US-4960873-A 3-pyridylisothiazoleazo compounds useful as disperse dyes BASF AKTIENGESELLSCHAFT (DE) 1990-10-02 US claimed
US-4016152-A SUITABLE FOR DYEING POLYESTERS BASF AKTIENGESELLSCHAFT (DT) 1977-04-05 US claimed
US-3933800-A O-SUBSTITUTED OXIMES, MICROBIOCIDES GRUPPO LEPETIT S.P.A. (IT) 1976-01-20 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-10308639-B2 Phosphatidylinositol 3-kinase inhibitors PIK3CA, AKT3, AKT2 TSHR 1850/4885NAAA 3176/4885CA1 3703/4885

“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.