SCHEMBL608389

SCHEMBL608389

CN(C)C(=S)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 1.00
MAPT P10636 3/20 1.00
HSP90AA1 P07900 2/20 0.70
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
HPGD P15428 4/20 0.56
GAA P10253 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
HSP90AB1 P08238 1/20 0.52
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
HSD17B10 Q99714 2/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
BACE1 P56817 1/20 0.45
LMNA P02545 2/20 0.44
ALOX15 P16050 1/20 0.42
MAPK1 P28482 1/20 0.42
FAAH O00519 1/20 0.41
PHGDH O43175 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
SCHEMBL8949752 0.82 HSP90AA1 (1.00) ALDH1A1MAPTHSP90AA1MEN1KMT2A
SCHEMBL9199685 0.80 HSP90AA1 (0.95) ALDH1A1MAPTHSP90AA1MEN1KMT2A
SCHEMBL15402110 0.80 ALDH1A1 (0.67) ALDH1A1MAPTHSP90AA1MEN1KMT2A
SCHEMBL429907 0.80 ALDH1A1 (0.67) ALDH1A1MAPTHSP90AA1MEN1KMT2A
SCHEMBL8949737 0.80 HSP90AA1 (0.95) ALDH1A1MAPTHSP90AA1MEN1KMT2A
SCHEMBL7819331 0.77 MAPT (0.62) ALDH1A1MAPTHSP90AA1MEN1KMT2A
SCHEMBL9652672 0.77 ALDH1A1 (0.62) ALDH1A1MAPTHSP90AA1MEN1KMT2A
SCHEMBL12808728 0.77 ALDH1A1 (0.61) ALDH1A1MAPTHSP90AA1MEN1KMT2A
SCHEMBL610580 0.76 ALDH1A1 (0.61) ALDH1A1MAPTHSP90AA1MEN1KMT2A
SCHEMBL21625862 0.76 HSP90AA1 (0.73) ALDH1A1MAPTHSP90AA1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4317124-A1 METHOD FOR PRODUCING ORGANIC FLUORINE COMPOUNDS DAIKIN INDUSTRIES, LTD. (JP) 2024-02-07 EP disclosed
US-20240018081-A1 METHOD FOR PRODUCING ORGANIC FLUORINE COMPOUNDS DAIKIN INDUSTRIES, LTD. (JP) 2024-01-18 US disclosed
WO-2024009998-A1 METHOD FOR PRODUCING FLUORINATED ORGANIC COMPOUND ダイキン工業株式会社 2024-01-11 WO disclosed
CN-116762033-A Composition, and optical material and lens using same 三菱瓦斯化学株式会社 2023-09-15 CN disclosed
EP-4223736-A1 PRODUCTION METHOD FOR FLUORINATED ORGANIC COMPOUND Daikin Industries, Ltd. (JP) 2023-08-09 EP disclosed
US-20230242468-A1 PRODUCTION METHOD FOR FLUORINATED ORGANIC COMPOUND DAIKIN INDUSTRIES, LTD. (JP) 2023-08-03 US disclosed
CN-116323555-A Composition, and optical material and lens using same 三菱瓦斯化学株式会社 2023-06-23 CN disclosed
CN-116249686-A Process for producing fluorinated organic compound 大金工业株式会社 2023-06-09 CN disclosed
CN-115989217-A Composition, and optical material and lens using the same 三菱瓦斯化学株式会社 2023-04-18 CN disclosed
CN-114945711-A Process for producing fluorine-containing organic compound 大金工业株式会社 2022-08-26 CN disclosed
WO-2003060192-A1 NON-TOXIC CORROSION-PROTECTION RINSES AND SEALS BASED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed
EP-1304316-A1 PROCESSES FOR THE PRODUCTION OF FLUORINATED ORGANIC COMPOUNDS AND FLUORINATING AGENTS Daikin Industries, Ltd. (JP) 2003-04-23 EP disclosed
CN-1161687-A Phenylacetic acid alkyl esters BASF AG (DE) 1997-10-08 CN disclosed
CN-1024004-C Bactericide ICI PLC (GB) 1994-03-16 CN disclosed
EP-0381330-B1 Fungicides ZENECA LTD (GB) 1993-12-29 EP disclosed
CN-1046523-A Sterilant ICI PLC (GB) 1990-10-31 CN disclosed
EP-0381330-A1 Fungicides ZENECA LIMITED (GB) 1990-08-08 EP disclosed
US-4078139-A Process for deoxygenating secondary alcohols SCHERING CORPORATION (US) 1978-03-07 US disclosed
US-4008264-A Process for the preparation of aromatic thiocarboxylic acid amides HOECHST AKTIENGESELLSCHAFT (DT) 1977-02-15 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 (2 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-20240018081-A1 METHOD FOR PRODUCING ORGANIC FLUORINE COMPOUNDS PFAS, FBL, FLNB ALDH1A1 1098/4885MAPT 1503/4885HSP90AA1 539/4885
US-20230242468-A1 PRODUCTION METHOD FOR FLUORINATED ORGANIC COMPOUND IPO5, PFAS, FBL ALDH1A1 2298/4885MAPT 1536/4885HSP90AA1 4460/4885

“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.