SCHEMBL6185779

SCHEMBL6185779

CN(C)c1ccc(C=O)cc1C#N

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
KDM4E B2RXH2 3/20 0.45
MAPT P10636 2/20 0.45
GAA P10253 1/20 0.45
CYP2A6 P11509 3/20 0.42
CYP2A13 Q16696 1/20 0.42
ALDH1A3 P47895 3/20 0.40
XDH P47989 1/20 0.40
TSHR P16473 1/20 0.39
ALDH3A1 P30838 4/20 0.38
EGFR P00533 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTGS2 P35354 1/20 0.34
RAB9A P51151 1/20 0.34
FDPS P14324 1/20 0.34
APP P05067 1/20 0.34

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
SCHEMBL16731702 0.83 ALDH1A3 (0.46) ALDH1A1KDM4EMAPTGAACYP2A6
SCHEMBL2292105 0.79 ALDH3A1 (0.61) ALDH1A1MAPTALDH1A3TSHRALDH3A1
SCHEMBL13123401 0.79 XDH (0.42) ALDH1A1KDM4EMAPTGAAXDH
SCHEMBL6899726 0.77 ALDH1A1 (0.47) ALDH1A1KDM4ECYP2A6TSHREGFR
SCHEMBL27694001 0.77 CYP2A6 (0.52) ALDH1A1KDM4ECYP2A6CYP2A13ALDH1A3
SCHEMBL29956523 0.76 TSHR (0.43) ALDH1A1KDM4ECYP2A6ALDH1A3TSHR
SCHEMBL6435855 0.76 TSHR (0.43) ALDH1A1KDM4ECYP2A6ALDH1A3TSHR
SCHEMBL26969028 0.74 CYP2A6 (0.51) ALDH1A1KDM4EMAPTCYP2A6CYP2A13
SCHEMBL30893368 0.73 ALDH1A3 (0.49) ALDH1A1KDM4ECYP2A6CYP2A13ALDH1A3
SCHEMBL31299760 0.73 CYP2A6 (0.48) ALDH1A1KDM4ECYP2A6CYP2A13ALDH1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118061627-A High-temperature-resistant fabric and preparation method thereof 上海晶芙化工科技有限公司 2024-05-24 CN claimed
CN-120287685-A Preparation method of high-temperature-resistant fabric 上海晶芙化工科技有限公司 2025-07-11 CN disclosed
CN-118061627-A High-temperature-resistant fabric and preparation method thereof 上海晶芙化工科技有限公司 2024-05-24 CN disclosed
CN-118061627-A High-temperature-resistant fabric and preparation method thereof 上海晶芙化工科技有限公司 2024-05-24 CN disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
EP-3606921-B1 NEW COMPOUNDS INHIBITORS OF THE YAP/TAZ-TEAD INTERACTION AND THEIR USE IN THE TREATMENT OF MALIGNANT MESOTHELIOMA. INVENTIVA (FR) 2022-06-01 EP disclosed
CN-108341799-B Novel indole derivatives for the treatment of cancer, viral infections and lung diseases 生物控制术公司 2022-01-25 CN disclosed
US-10851054-B2 Derivatives of indole for the treatment of cancer, viral infections and lung diseases BIOKINESIS (FR) 2020-12-01 US disclosed
US-20200115353-A1 NEW COMPOUNDS INHIBITORS OF THE YAP/TAZ-TEAD INTERACTION AND THEIR USE IN THE TREATMENT OF MALIGNANT MESOTHELIOMA INVENTIVA (FR) 2020-04-16 US disclosed
EP-3606921-A1 NEW COMPOUNDS INHIBITORS OF THE YAP/TAZ-TEAD INTERACTION AND THEIR USE IN THE TREATMENT OF MALIGNANT MESOTHELIOMA. Inventiva (FR) 2020-02-12 EP disclosed
US-20170233342-A1 NEW DERIVATIVES OF INDOLE FOR THE TREATMENT OF CANCER, VIRAL INFECTIONS AND LUNG DISEASES DIACCURATE (FR) 2017-08-17 US disclosed
US-9643923-B2 Derivatives of indole for the treatment of cancer, viral infections and lung diseases BIOKINESIS (FR) 2017-05-09 US disclosed
US-20150307450-A1 NEW DERIVATIVES OF INDOLE FOR THE TREATMENT OF CANCER, VIRAL INFECTIONS AND LUNG DISEASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2015-10-29 US disclosed
EP-2928864-A1 NEW DERIVATIVES OF INDOLE FOR THE TREATMENT OF CANCER, VIRAL INFECTIONS AND LUNG DISEASES Biokinesis (FR) 2015-10-14 EP disclosed
US-9023998-B2 Near infrared fluorogen and fluorescent activating proteins for in vivo imaging and live-cell biosensing CARNEGIE MELLON UNIVERSITY (US) 2015-05-05 US disclosed
US-20140243509-A1 NEAR INFRARED FLUOROGEN AND FLUORESCENT ACTIVATING PROTEINS FOR IN VIVO IMAGING AND LIVE-CELL BIOSENSING CARNEGIE MELLON UNIVERSITY 2014-08-28 US disclosed
WO-2014086964-A1 NEW DERIVATIVES OF INDOLE FOR THE TREATMENT OF CANCER, VIRAL INFECTIONS AND LUNG DISEASES BIOKINESIS (FR) 2014-06-12 WO disclosed
EP-1534676-B1 PIPERIDINETRIOL DERIVATIVES AS INHIBITORS OF GLYCOSYLCERAMIDE SYNTHASE ACTELION PHARMACEUTICALS LTD (CH) 2012-09-12 EP disclosed
EP-1534676-A1 PIPERIDINETRIOL DERIVATIVES AS INHIBITORS OF GLYCOSYLCERAMIDE SYNTHASE Oxford GlycoSciences (UK) Limited (GB) 2005-06-01 EP disclosed
WO-2004007453-A1 PIPERIDINETRIOL DERIVATIVES AS INHIBITORS OF GLYCOSYLCERAMIDE SYNTHASE OXFORD GLYCOSCIENCES (UK) LTD (GB) 2004-01-22 WO 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-20140243509-A1 NEAR INFRARED FLUOROGEN AND FLUORESCENT ACTIVATING PROTEINS FOR IN VIVO IMAGING AND LIVE-CELL BIOSENSING FUCA1, TYR, HBG2 ALDH1A1 1815/4885KDM4E 3374/4885MAPT 2589/4885
US-20150307450-A1 NEW DERIVATIVES OF INDOLE FOR THE TREATMENT OF CANCER, VIRAL INFECTIONS AND LUNG DISEASES IDO2, IDO1, ING2 ALDH1A1 2891/4885KDM4E 1505/4885MAPT 3437/4885
US-20170233342-A1 NEW DERIVATIVES OF INDOLE FOR THE TREATMENT OF CANCER, VIRAL INFECTIONS AND LUNG DISEASES IDO2, IDO1, ING2 ALDH1A1 2891/4885KDM4E 1505/4885MAPT 3437/4885
US-20200115353-A1 NEW COMPOUNDS INHIBITORS OF THE YAP/TAZ-TEAD INTERACTION AND THEIR USE IN THE TREATMENT OF MALIGNANT MESOTHELIOMA YAP1, TEAD2, TEAD1 ALDH1A1 3397/4885KDM4E 1436/4885MAPT 1811/4885
US-10851054-B2 Derivatives of indole for the treatment of cancer, viral infections and lung diseases IDO2, IDO1, ING2 ALDH1A1 2533/4885KDM4E 1237/4885MAPT 3706/4885

“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.