SCHEMBL3369467

SCHEMBL3369467

Cc1ccc(C=C(C#N)C#N)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 11/20 0.77
MAPT P10636 11/20 0.77
MEN1 O00255 10/20 0.77
ALDH1A1 P00352 10/20 0.77
KDM4E B2RXH2 5/20 0.77
NPSR1 Q6W5P4 4/20 0.77
LMNA P02545 4/20 0.77
POLB P06746 1/20 0.77
THRB P10828 1/20 0.65
CISD1 Q9NZ45 1/20 0.65
EGFR P00533 6/20 0.63
HPGD P15428 5/20 0.62
CYP3A4 P08684 4/20 0.62
TSHR P16473 4/20 0.62
NFKB1 P19838 4/20 0.62
BLM P54132 4/20 0.62
PMP22 Q01453 4/20 0.62
CYP1A2 P05177 3/20 0.62
APEX1 P27695 1/20 0.62
SMN1; SMN2 Q16637 5/20 0.53

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
SCHEMBL16705993 0.94 MAPT (0.68) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL17466932 0.88 MAPT (1.00) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL19469440 0.88 KMT2A (0.59) KMT2AMAPTMEN1ALDH1A1KDM4E
Benzoic Acid SCHEMBL28633844 0.83 ALDH1A1 (0.53) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL17466936 0.81 MAPT (0.85) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL11957026 0.80 GABRA1 (0.53) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL13908793 0.80 GABRA1 (0.53) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL12755365 0.80 GABRA1 (0.53) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL1238796 0.79 MEN1 (1.00) KMT2AMAPTMEN1ALDH1A1KDM4E
SCHEMBL21430771 0.78 ALDH1A1 (0.46) KMT2AMAPTMEN1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113372510-B Preparation method of viscosity-reducing and mud-resisting polycarboxylate superplasticizer 贵州鼎盛建材实业有限公司 2022-08-19 CN claimed
CN-113372510-A Preparation method of viscosity-reducing and mud-resisting polycarboxylate superplasticizer 贵州鼎盛建材实业有限公司 2021-09-10 CN claimed
CN-120247768-B 2, 3-Disubstituted indole derivative and preparation method thereof 齐鲁理工学院 2025-08-05 CN disclosed
CN-120247768-A 2, 3-Disubstituted indole derivative and preparation method thereof 齐鲁理工学院 2025-07-04 CN disclosed
CN-117551025-A Preparation method of 4, 4-dicyano-2-alkyl-pyrrolidine-2-carboxylic ester derivative 华北水利水电大学 2024-02-13 CN disclosed
CN-116535368-A Dicyanomethane compound and synthesis method and application thereof 浙江理工大学嵊州创新研究院有限公司 2023-08-04 CN disclosed
CN-114177942-B Catalyst for condensation reaction of aldehyde and malononitrile Knoevenagel and preparation method thereof 兰州大学 2023-05-12 CN disclosed
CN-113058653-B Catalyst for Knoevenagel condensation reaction of aldehyde and malononitrile and preparation method thereof 兰州大学 2022-09-16 CN disclosed
CN-113372510-B Preparation method of viscosity-reducing and mud-resisting polycarboxylate superplasticizer 贵州鼎盛建材实业有限公司 2022-08-19 CN disclosed
EP-3553097-B1 COPOLYMER AND OPTICAL FILM USING SAME TOSOH CORP (JP) 2022-05-04 EP disclosed
US-20220096450-A1 Compounds and Methods for Treating or Preventing Heart Failure DREXEL UNIVERSITY 2022-03-31 US disclosed
US-20030216382-A1 Pyridine and pyrimidine derivatives HOFFMAN-LA ROCHE INC. 2003-11-20 US disclosed
WO-2003068757-A1 NOVEL PYRIDIN- AND PYRIMIDIN-DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-08-21 WO disclosed
EP-0357783-B1 SECONDARY NON-LINEAR OPTICAL MATERIAL AND NON-LINEAR OPTICAL ELEMENT PREPARED THEREFROM SUMITOMO ELECTRIC INDUSTRIES (JP) 1994-10-26 EP disclosed
EP-0357783-A1 SECONDARY NON-LINEAR OPTICAL MATERIAL AND NON-LINEAR OPTICAL ELEMENT PREPARED THEREFROM SUMITOMO ELECTRIC INDUSTRIES, LTD. (JP) 1990-03-14 EP disclosed
US-4719245-A TRIMERIZATION CATALYST THE DOW CHEMICAL COMPANY (US) 1988-01-12 US disclosed
US-4703099-A CATALYTICALLY TRIMERIZING ISOCYANATES THE DOW CHEMICAL COMPANY (US) 1987-10-27 US disclosed
US-4632989-A KETENE AMINAL-OLEFIN REACTION PRODUCT AS CATALYSTS THE DOW CHEMICAL COMPANY (US) 1986-12-30 US disclosed
US-4536490-A REACTION PRODUCT OF KETENE-AMINAL AND UNSATURATED COMPOUND THE UPJOHN COMPANY (US) 1985-08-20 US disclosed
US-4184871-A A,B-UNSATURATED NITRILE SENSITIZER MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) 1980-01-22 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-20220096450-A1 Compounds and Methods for Treating or Preventing Heart Failure SQOR, QSOX1, KEAP1 KMT2A 677/4885MAPT 4525/4885MEN1 3644/4885
US-20030216382-A1 Pyridine and pyrimidine derivatives DPP4, GPR119, G6PC1 KMT2A 3893/4885MAPT 4559/4885MEN1 3734/4885

“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.