SCHEMBL9909077

SCHEMBL9909077

Cc1nc(C)c(C#N)c(C)c1C#N

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.46
KDM4E B2RXH2 8/20 0.44
HTT P42858 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
GLA P06280 1/20 0.42
TSHR P16473 1/20 0.42
HSD17B10 Q99714 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
ADRA2A P08913 1/20 0.37
ADORA2A P29274 1/20 0.37
HPGD P15428 3/20 0.36
GAA P10253 1/20 0.36
MAPK1 P28482 1/20 0.35
RECQL P46063 2/20 0.34
MAPT P10636 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL15128087 0.89 KDM4E (0.41) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL16479797 0.83 ALDH1A1 (0.64) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL2614484 0.83 HTT (0.63) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL13389006 0.82 HTT (0.42) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL16476940 0.79 ALDH1A1 (0.37) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL14155640 0.78 KDM4E (0.41) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL9906924 0.78 KDM4E (0.35) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL12295133 0.77 ALDH1A1 (0.44) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL4632645 0.77 ALDH1A1 (0.44) ALDH1A1KDM4EHTTMEN1KMT2A
SCHEMBL13431156 0.77 KDM4E (0.39) ALDH1A1KDM4EHTTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118526517-A Method for adsorbing enterogenic protein combined uremic toxin and precursor thereof 南开大学 2024-08-23 CN claimed
CN-114773556-B Green solid-phase synthesis method of covalent organic framework material 耀科新材料(苏州)有限公司 2024-06-04 CN claimed
WO-2023124952-A1 GREEN SOLID-PHASE SYNTHESIS METHOD FOR COVALENT ORGANIC FRAMEWORK MATERIAL 张振杰 2023-07-06 WO claimed
CN-115010885-B Preparation method of copper-based metal covalent organic framework and application of copper-based metal covalent organic framework in photocatalytic detoxification sulfur mustard simulant 南昌大学 2023-06-27 CN claimed
CN-116284907-A Sp (sp) 2 Carbon conjugated two-dimensional polymer film and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2023-06-23 CN claimed
CN-116239759-A Conjugated two-dimensional polymer film and preparation method and application thereof 中国科学院宁波材料技术与工程研究所 2023-06-09 CN claimed
CN-115286757-B Covalent organic framework material based on multi-nitrogen olefin connection and preparation method and application thereof 中原工学院 2023-03-10 CN claimed
CN-115286757-A Covalent organic framework material based on multi-nitrogen olefin connection and preparation method and application thereof 中原工学院 2022-11-04 CN claimed
CN-115010885-A Preparation method of copper-based metal covalent organic framework and application of copper-based metal covalent organic framework in photocatalysis detoxification sulfur mustard simulant 南昌大学 2022-09-06 CN claimed
CN-114773556-A Green solid-phase synthesis method of covalent organic framework material 南开大学 2022-07-22 CN claimed
US-20250066528-A1 Method for Synthesizing a Covalent Organic Framework Material YOCOF MAT SUZHOU CO LTD (CN) 2025-02-27 US disclosed
CN-118526517-A Method for adsorbing enterogenic protein combined uremic toxin and precursor thereof 南开大学 2024-08-23 CN disclosed
CN-114773556-B Green solid-phase synthesis method of covalent organic framework material 耀科新材料(苏州)有限公司 2024-06-04 CN disclosed
CN-117844007-A Sp (sp) 2 Preparation method of carbon conjugated two-dimensional polymer film 中国科学院宁波材料技术与工程研究所 2024-04-09 CN disclosed
WO-2023124952-A1 GREEN SOLID-PHASE SYNTHESIS METHOD FOR COVALENT ORGANIC FRAMEWORK MATERIAL 张振杰 2023-07-06 WO disclosed
CN-114409862-A 2,4, 6-trimethylpyridine-based vinyl-bridged two-dimensional covalent organic framework material and preparation method thereof 上海交通大学 2022-04-29 CN disclosed
CN-110591109-B Carbon-carbon double bond bridged full-carbon skeleton two-dimensional conjugated organic framework material and preparation method thereof 上海交通大学 2021-09-24 CN disclosed
CN-110591109-A Carbon-carbon double bond bridged full-carbon skeleton two-dimensional conjugated organic framework material and preparation method thereof 上海交通大学 2019-12-20 CN disclosed
US-8198456-B2 e.g. 1,4-dihydro-4-(1H-indazol-5-yl)-2,6-dimethyl-3,5-pyridinedicarbonitrile; c-Met tyrosine kinase inhibitor; antitumor agent; lung, liver, gastric and breast solid tumors; pancreatic cancer, glioma, and hepatocellular carcinoma BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-06-12 US disclosed
US-20080176833-A1 DIHYDROPYRIDINE DERIVATIVES AS USEFUL AS PROTEIN KINASE INHIBITORS BAYER INTELLECTUAL PROPERTY GMBH (DE) 2008-07-24 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 (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-20080176833-A1 DIHYDROPYRIDINE DERIVATIVES AS USEFUL AS PROTEIN KINASE INHIBITORS MET, DMPK, RET ALDH1A1 1341/4885KDM4E 1582/4885HTT 2390/4885

“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.