SCHEMBL6285686

SCHEMBL6285686

CC(=O)N1CCN(CCCOC(=O)Oc2ccc([N+](=O)[O-])cc2)CC1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 2/20 0.60
HRH1 P35367 2/20 0.60
ALDH1A1 P00352 4/20 0.48
HRH3 Q9Y5N1 1/20 0.48
HPGD P15428 1/20 0.48
KDM4E B2RXH2 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
DRD3 P35462 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
KCNJ1 P48048 1/20 0.46
KCNH2 Q12809 1/20 0.46
EPHX2 P34913 1/20 0.46
MGLL Q99685 1/20 0.45
HTR2A P28223 1/20 0.45
KMT2A Q03164 1/20 0.44

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
SCHEMBL5857294 0.90 HRH2 (0.57) HRH2HRH1ALDH1A1HRH3KDM4E
Hydrochloric Acid SCHEMBL16107158 0.86 HRH3 (0.62) HRH2HRH1ALDH1A1HRH3KDM4E
Hydrochloric Acid SCHEMBL16107182 0.85 HRH3 (0.60) HRH2HRH1ALDH1A1HRH3KDM4E
Hydrochloric Acid SCHEMBL16694955 0.85 HRH3 (0.60) HRH2HRH1ALDH1A1HRH3KDM4E
SCHEMBL23061496 0.84 HRH2 (0.51) HRH2HRH1ALDH1A1HRH3KDM4E
SCHEMBL314573 0.82 ALDH1A1 (0.53) HRH2HRH1ALDH1A1HRH3KDM4E
SCHEMBL9471555 0.81 DRD3 (0.70) HRH2HRH1ALDH1A1HRH3HPGD
SCHEMBL315786 0.80 ALDH1A1 (0.57) HRH2HRH1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL763025 0.79 HTR2A (0.57) ALDH1A1SMN1; SMN2MGLLHTR2AKMT2A
SCHEMBL16088361 0.79 KDM4E (0.67) HRH2HRH1ALDH1A1HRH3KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6846925-B2 Colchinol derivatives as angiogenesis inhibitors ANGIOGENE PHARMACEUTICALS LIMITED (GB) 2005-01-25 US disclosed
US-20040142909-A1 Colchinol derivatives as angiogenesis inhibitors ANGIOGENE PHARMACEUTICALS LIMITED 2004-07-22 US disclosed
US-6720323-B2 N-((5S)-3,9,10,11-TETRAMETHOXY-6,7-DIHYDRO-5H-DIBENZO(A,C) CYCLOHEPTEN-5-YL)-2-(2-AMINOACETYLAMINO)ACETAMIDE; DESTROYS NEWLY FORMED VASCULATURE WHILE LEAVING UNAFFECTED NORMAL, MATURE VASCULATURE. ANGIOGENE PHARMACEUTICALS LIMITED (GB) 2004-04-13 US disclosed
US-20030195173-A1 Colchinol derivatives as angiogenesis inhibitors ANGIOGENE PHARMACEUTICALS LIMITED (GB) 2003-10-16 US disclosed
EP-1301498-A1 COLCHINOL DERIVATIVES AS ANGIOGENESIS INHIBITORS Angiogene Pharmaceuticals Limited (GB) 2003-04-16 EP disclosed
WO-2002008213-A1 COLCHINOL DERIVATIVES AS ANGIOGENESIS INHIBITORS ANGIOGENE PHARMACEUTICALS LIMITED (GB) 2002-01-31 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 (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-20030195173-A1 Colchinol derivatives as angiogenesis inhibitors FLT1, CCNO, FLT4 HRH2 389/4885HRH1 526/4885ALDH1A1 3893/4885
US-20040142909-A1 Colchinol derivatives as angiogenesis inhibitors FLT1, CCNO, FLT4 HRH2 389/4885HRH1 526/4885ALDH1A1 3911/4885

“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.