SCHEMBL6332402

SCHEMBL6332402

NNC(=O)C1=C(COC23CC4CC(CC(C4)C2)C3)NC(C2CCCCC2)N1OCc1ccccc1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 1/20 0.37
EPHX2 P34913 6/20 0.36
FKBP1A P62942 2/20 0.35
FAAH O00519 4/20 0.35
CNR2 P34972 4/20 0.35
CNR1 P21554 2/20 0.35
SCN9A Q15858 2/20 0.34
SGMS2 Q8NHU3 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL6334399 0.91 CCKBR (0.37) CCKBREPHX2FKBP1AFAAHCNR2
SCHEMBL6331005 0.88 TSHR (0.39) CCKBREPHX2FKBP1A
SCHEMBL7045618 0.85 CCKBR (0.39) CCKBREPHX2FKBP1AFAAHCNR2
SCHEMBL6330066 0.81 CCKBR (0.35) CCKBREPHX2FKBP1AFAAHCNR2
SCHEMBL6334504 0.79 TSHR (0.40) CCKBREPHX2FKBP1A
SCHEMBL6338565 0.73 SMN1; SMN2 (0.40) CCKBRFAAHCNR2HPGD
SCHEMBL6340323 0.73 SMN1; SMN2 (0.42) CCKBREPHX2FAAHCNR2HPGD
SCHEMBL6334377 0.67 CCKBR (0.33) CCKBREPHX2
SCHEMBL1477271 0.66 TRPV6 (0.47) EPHX2FAAHCNR2CNR1HPGD
SCHEMBL6339911 0.64 CCKBR (0.44) CCKBREPHX2FKBP1AFAAHCNR2

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-6878734-B2 Gastrin and cholecystokinin receptor ligands(II) JAMES BLACK FOUNDATION LIMITED (GB) 2005-04-12 US disclosed
US-20030199565-A1 Gastrin and cholecystokinin receptor ligands(II) JAMES BLACK FOUNDATION LIMITED (GB) 2003-10-23 US disclosed
WO-2001085723-A1 GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS (II) 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-20030199565-A1 Gastrin and cholecystokinin receptor ligands(II) GRPR, CCKBR, GIPR CCKBR 2/4885EPHX2 2106/4885FKBP1A 1271/4885

“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.