SCHEMBL209077

SCHEMBL209077

O=C1C[C]Nc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.38
MAOB P27338 2/20 0.38
PDGFRA P16234 1/20 0.38
FER P16591 1/20 0.38
LTK P29376 1/20 0.38
CDK8 P49336 1/20 0.38
ACVR1 Q04771 1/20 0.38
LRRK2 Q5S007 1/20 0.38
DYRK1B Q9Y463 1/20 0.38
TNKS2 Q9H2K2 3/20 0.36
GSK3B P49841 1/20 0.34
PDE7A Q13946 1/20 0.34
PDE7B Q9NP56 1/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
CDC25B P30305 1/20 0.33
BCHE P06276 1/20 0.33
CES1 P23141 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
SCHEMBL209266 0.73 TGM2 (0.36) MAOBKDM4E
SCHEMBL207191 0.73 CES1 (0.44) LTKCDK8ACVR1LRRK2DYRK1B
SCHEMBL207213 0.73 CMA1 (0.40) LRRK2KMT2AMEN1CES1
SCHEMBL211048 0.73 TGM2 (0.44) LRRK2GSK3BKMT2AMEN1CES1
SCHEMBL208827 0.73 PARP1 (0.38) LRRK2KMT2AMEN1KDM4E
SCHEMBL19678 0.69
SCHEMBL21311994 0.67 LRRK2 (0.58) MAOAMAOBPDGFRAFERLTK
SCHEMBL1551702 0.67 MAOA (0.41) MAOAMAOBPDGFRAFERLTK
SCHEMBL68595 0.67 CA12 (0.45) MAOAMAOBPDGFRAFERLTK
SCHEMBL61310 0.67 CA12 (0.50) MAOAMAOBGSK3BKMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090239857-A1 TRIAMINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-09-24 US claimed
US-7576135-B2 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2009-08-18 US claimed
EP-1864982-A1 TRIAMINE DERIVATIVE DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-12-12 EP claimed
US-20070129371-A1 Novel ethylenediamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2007-06-07 US claimed
US-20060252837-A1 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2006-11-09 US claimed
US-20050245565-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-11-03 US claimed
EP-1577301-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-21 EP claimed
EP-1577302-A1 NOVEL ETHYLENEDIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-09-21 EP claimed
US-20050119486-A1 Diamine derivatives DAIICHI SANKYO COMPANY, LIMITED (JP) 2005-06-02 US claimed
US-20050020645-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-01-27 US claimed
EP-1415992-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 EP claimed
EP-1405852-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-07 EP claimed
EP-4362917-A2 AEROSOL COMPOSITION FOR PULMONARY DELIVERY OF FLAGELLIN Institut National de la Santé et de la Recherche Médicale (INSERM) (FR) 2024-05-08 EP disclosed
WO-2023275292-A2 AEROSOL COMPOSITION FOR PULMONARY DELIVERY OF FLAGELLIN INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2023-01-05 WO disclosed
US-10736937-B2 Methods and pharmaceutical compositions for the treatment of bacterial superinfections post-influenza INSERM (Institut National de la Santé et de la Recherche Médicale) (FR) 2020-08-11 US disclosed
EP-3236988-B1 PHARMACEUTICAL COMPOSITIONS FOR THE TREATMENT OF BACTERIAL SUPERINFECTIONS POST-INFLUENZA INST NAT SANTE RECH MED (FR) 2020-06-24 EP disclosed
EP-1415992-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 EP disclosed
EP-1405852-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-04-07 EP disclosed
US-4616014-A HYPOTENSIVE AGENTS, ANTICOAGULANTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1986-10-07 US disclosed
EP-0077983-A1 Triazine derivatives, processes for preparation thereof and pharmaceutical compositions comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1983-05-04 EP 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 (6 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-20070129371-A1 Novel ethylenediamine derivatives C1R, C9, C1S MAOA 2820/4885MAOB 1441/4885PDGFRA 2189/4885
US-20090239857-A1 TRIAMINE DERIVATIVE F2, F12, F3 MAOA 65/4885MAOB 208/4885PDGFRA 60/4885
US-20060252837-A1 Cyclic diamine derivatives useful as agents for preventing and/or treating cerebral infarction, cerebral embolism, myocardial infarction, angina pectoris, pulmonary infarction, pulmonary embolism; inhibit activated blood coagulation factor X F2, C1S, C9 MAOA 2552/4885MAOB 2043/4885PDGFRA 2476/4885
US-20050020645-A1 Diamine derivatives C9, C1S, C1R MAOA 3264/4885MAOB 2147/4885PDGFRA 3407/4885
US-20050245565-A1 Diamine derivatives C9, C1S, C1R MAOA 3264/4885MAOB 2147/4885PDGFRA 3407/4885
US-20050119486-A1 Diamine derivatives C9, C1S, C1R MAOA 3264/4885MAOB 2147/4885PDGFRA 3407/4885

“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.