SCHEMBL6159375

SCHEMBL6159375

CCOC(=O)c1nc[nH]c1CC1CCCCCC1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.55
KDM4E B2RXH2 3/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
LMNA P02545 3/20 0.44
ELANE P08246 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 1/20 0.39
HTR3A P46098 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
GAA P10253 1/20 0.39
POLB P06746 1/20 0.39

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
SCHEMBL10278987 0.78 KDM4E (0.59) ALDH1A1KDM4ESMN1; SMN2LMNAMEN1
SCHEMBL5870445 0.77 KDM4E (0.58) ALDH1A1KDM4ESMN1; SMN2LMNAMEN1
SCHEMBL15563767 0.75 HCAR2 (0.41) ALDH1A1KDM4ELMNAELANEMEN1
SCHEMBL15565115 0.75 LMNA (0.48) ALDH1A1KDM4ELMNAMEN1KMT2A
SCHEMBL18256063 0.73 SMN1; SMN2 (0.55) ALDH1A1KDM4ESMN1; SMN2LMNAMEN1
SCHEMBL2114938 0.72 KDM4E (0.63) ALDH1A1KDM4ESMN1; SMN2LMNAMEN1
SCHEMBL1417913 0.70 KDM4E (0.81) ALDH1A1KDM4ESMN1; SMN2LMNAMEN1
SCHEMBL12866914 0.70 KDM4E (0.50) ALDH1A1KDM4ESMN1; SMN2LMNAMEN1
SCHEMBL311900 0.69 KDM4E (0.64) ALDH1A1KDM4ESMN1; SMN2LMNAMEN1
SCHEMBL4957306 0.69 KDM4E (0.59) ALDH1A1KDM4ESMN1; SMN2LMNAMEN1

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
EP-1178969-B1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS BLACK JAMES FOUNDATION (GB) 2005-07-13 EP disclosed
US-20030195240-A1 Pharmaceutical compositions comprising proton pump inhibitors and gastrin/cholecystokinin receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2003-10-16 US disclosed
US-6479531-B1 Gastrin and cholecystokinin receptor ligands JAMES BLACK FOUNDATION LIMITED (GB) 2002-11-12 US disclosed
EP-1178969-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2002-02-13 EP disclosed
WO-2001085167-A1 PHARMACEUTICAL COMPOSITIONS COMPRISING PROTON PUMP INHIBITORS AND GASTRIN/CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2001-11-15 WO disclosed
WO-2000027823-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2000-05-18 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 (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-20030195240-A1 Pharmaceutical compositions comprising proton pump inhibitors and gastrin/cholecystokinin receptor ligands GIPR, CCKAR, CCKBR ALDH1A1 4620/4885KDM4E 4090/4885SMN1; SMN2 4329/4885

“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.