SCHEMBL3458697

SCHEMBL3458697

[CH2]CCCN1CCN(C(=O)c2ccccc2)CC1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 4/20 0.69
▸ HTR2A P28223 4/20 0.69
▸ SIGMAR1 Q99720 1/20 0.69
▸ KMT2A Q03164 3/20 0.66
▸ MEN1 O00255 2/20 0.66
▸ KCNH2 Q12809 1/20 0.66
▸ KCNA5 P22460 3/20 0.61
▸ KDM4E B2RXH2 2/20 0.57
▸ ALDH1A1 P00352 2/20 0.57
▸ ALOX15 P16050 1/20 0.56
▸ DRD3 P35462 1/20 0.54
▸ BLM P54132 1/20 0.54

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
SCHEMBL9834626 0.90 KMT2A (0.69) DRD2HTR2ASIGMAR1KMT2AMEN1
SCHEMBL18770805 0.90 DRD2 (0.82) DRD2HTR2ASIGMAR1KMT2AMEN1
SCHEMBL7972984 0.84 DRD2 (0.69) DRD2HTR2ASIGMAR1KMT2AMEN1
SCHEMBL10722663 0.84 DRD2 (0.69) DRD2HTR2ASIGMAR1KMT2AMEN1
SCHEMBL771246 0.83 MEN1 (0.64) DRD2HTR2ASIGMAR1KMT2AMEN1
SCHEMBL16980657 0.83 SIGMAR1 (0.72) DRD2HTR2ASIGMAR1KMT2AMEN1
SCHEMBL15961276 0.83 SIGMAR1 (0.91) DRD2HTR2ASIGMAR1KMT2AMEN1
SCHEMBL2549342 0.83 SIGMAR1 (0.72) DRD2HTR2ASIGMAR1KMT2AMEN1
Hydrochloric Acid SCHEMBL7983779 0.83 DRD2 (0.68) DRD2HTR2ASIGMAR1KMT2AMEN1
SCHEMBL1192814 0.82 KMT2A (0.71) DRD2HTR2ASIGMAR1KMT2AMEN1

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4599062-B2 — — 2010-12-15 — — JP claimed
EP-1487444-B9 USE OF PYRIDYL AMIDES AS INHIBITORS OF ANGIOGENESIS ASTELLAS DEUTSCHLAND GMBH (DE) 2010-07-21 — — EP claimed
EP-1487444-B1 USE OF PYRIDYL AMIDES AS INHIBITORS OF ANGIOGENESIS ASTELLAS DEUTSCHLAND GMBH (DE) 2009-12-30 — — EP claimed
US-20060052419-A1 Use of pyridly amides as inhibitors of angiogenesis ASTELLAS DEUTSCHLAND GMBH (DE) 2006-03-09 — — US claimed
JP-2005528361-A — — 2005-09-22 — — JP claimed
EP-1487444-A1 USE OF PYRIDYL AMIDES AS INHIBITORS OF ANGIOGENESIS Fujisawa Deutschland GmbH (DE) 2004-12-22 — — EP claimed
WO-2003080054-A1 USE OF PYRIDYL AMIDES AS INHIBITORS OF ANGIOGENESIS FUJISAWA DEUTSCHLAND GMBH (DE) 2003-10-02 — — WO claimed
EP-1348434-A1 Use of pyridyl amides as inhibitors of angiogenesis Fujisawa Deutschland GmbH (DE) 2003-10-01 — — EP claimed
EP-1487444-B9 USE OF PYRIDYL AMIDES AS INHIBITORS OF ANGIOGENESIS ASTELLAS DEUTSCHLAND GMBH (DE) 2010-07-21 — — EP disclosed
EP-1487444-B1 USE OF PYRIDYL AMIDES AS INHIBITORS OF ANGIOGENESIS ASTELLAS DEUTSCHLAND GMBH (DE) 2009-12-30 — — EP disclosed
US-20060052419-A1 Use of pyridly amides as inhibitors of angiogenesis ASTELLAS DEUTSCHLAND GMBH (DE) 2006-03-09 — — US disclosed
EP-1487444-A1 USE OF PYRIDYL AMIDES AS INHIBITORS OF ANGIOGENESIS Fujisawa Deutschland GmbH (DE) 2004-12-22 — — EP disclosed
WO-2003080054-A1 USE OF PYRIDYL AMIDES AS INHIBITORS OF ANGIOGENESIS FUJISAWA DEUTSCHLAND GMBH (DE) 2003-10-02 — — WO disclosed
EP-1348434-A1 Use of pyridyl amides as inhibitors of angiogenesis Fujisawa Deutschland GmbH (DE) 2003-10-01 — — 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 (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-20060052419-A1 Use of pyridly amides as inhibitors of angiogenesis FLT1, VEGFA, FLT4 DRD2 4246/4885HTR2A 2225/4885SIGMAR1 3828/4885

“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.

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