SCHEMBL6064529

SCHEMBL6064529

O=C(O)c1cccc(NC(=O)c2c(COC34CC5CC(CC(C5)C3)C4)nnn2C2CCCCCC2)c1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.59
MAPT P10636 2/20 0.44
RXFP1 Q9HBX9 2/20 0.44
TP53 P04637 1/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
EPHX2 P34913 1/20 0.43
HIF1A Q16665 1/20 0.41
EPAS1 Q99814 1/20 0.41

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
SCHEMBL6064507 0.87 CCKBR (0.63) CCKBRMAPTRXFP1TP53MEN1
SCHEMBL6489556 0.85 CCKBR (0.58) CCKBRMEN1NPC1RAB9AKMT2A
SCHEMBL6064921 0.83 CCKBR (0.64) CCKBRMEN1NPC1RAB9AKMT2A
SCHEMBL6065076 0.83 CCKBR (0.64) CCKBRMEN1NPC1RAB9AKMT2A
SCHEMBL6501963 0.83 CCKBR (0.56) CCKBRMAPTRXFP1TP53MEN1
SCHEMBL6158876 0.82 CCKBR (0.64) CCKBRMEN1NPC1RAB9AKMT2A
SCHEMBL6161329 0.77 CCKBR (0.55) CCKBREPHX2HIF1AEPAS1
SCHEMBL6065068 0.77 CCKBR (0.59) CCKBRMEN1NPC1RAB9AKMT2A
SCHEMBL6498774 0.76 CCKBR (0.55) CCKBRMEN1NPC1RAB9AKMT2A
SCHEMBL6065049 0.76 CCKBR (0.63) CCKBREPHX2HIF1AEPAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7105558-B2 Gastrin and cholecystokinin receptor lignads (iv) THE JAMES BLACK FOUNDATION LIMITED (GB) 2006-09-12 US disclosed
US-20030195237-A1 Gastrin and cholecystokinin receptor lignads (iv) JAMES BLACK FOUNDATION LIMITED (GB) 2003-10-16 US disclosed
WO-2001085704-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS (IV) JAMES BLACK FOUNDATION LIMITED (GB) 2001-11-15 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-20030195237-A1 Gastrin and cholecystokinin receptor lignads (iv) CCKAR, CCKBR, GRPR CCKBR 2/4885MAPT 4796/4885RXFP1 71/4885

“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.