SCHEMBL6489141

SCHEMBL6489141

Cc1ccccc1-n1nc(COC23CC4CC(CC(C4)C2)C3)c(C(=O)Nc2cccc(C(=O)O)c2)c1O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 3/20 0.49
POLB P06746 1/20 0.43
EPHX2 P34913 1/20 0.41
CCKAR P32238 2/20 0.40

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
SCHEMBL6492741 0.92 RAB9A (0.49) CCKBRPOLB
SCHEMBL6065051 0.84 CCKBR (0.54) CCKBR
SCHEMBL6531513 0.84 CCKBR (0.50) CCKBRPOLBEPHX2CCKAR
SCHEMBL6489556 0.81 CCKBR (0.58) CCKBREPHX2CCKAR
SCHEMBL6065554 0.80 CCKBR (0.53) CCKBR
SCHEMBL6065159 0.78 CCKBR (0.53) CCKBR
SCHEMBL6064608 0.77 CCKBR (0.54) CCKBREPHX2
SCHEMBL6064883 0.76 CCKBR (0.55) CCKBREPHX2
SCHEMBL6065177 0.76 CCKBR (0.53) CCKBR
SCHEMBL6065041 0.76 CCKBR (0.53) CCKBR

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-6956053-B2 Pyrazole derivatives and their use as gastrin and cholecystokin receptor ligands THE JAMES BLACK FOUNDATION LIMITED (GB) 2005-10-18 US disclosed
US-20030207874-A1 Pyrazole derivatives and their use as gastrin and cholecystokin receptor ligands JAMES BLACK FOUNDATION LIMITED, THE (GB) 2003-11-06 US disclosed
WO-2001090078-A1 PYRAZOLE DERIVATIVES AND THEIR USE AS GASTRIN AND CHOLECYSTOKIN IN RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 2001-11-29 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-20030207874-A1 Pyrazole derivatives and their use as gastrin and cholecystokin receptor ligands CCKBR, GRPR, CCKAR CCKBR 1/4885POLB 4006/4885EPHX2 3234/4885

“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.