SCHEMBL5454490

SCHEMBL5454490

CCCCCC1CC2CCC(C1)N2CCCn1cc(C(=O)C2CC2)c2cccc(OC)c21

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 12/20 0.51
ALDH1A1 P00352 1/20 0.49
MAPT P10636 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CNR1 P21554 10/20 0.45
MEN1 O00255 1/20 0.41
KMT2A Q03164 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
SCHEMBL14411117 1.00 CNR2 (0.51) CNR2ALDH1A1MAPTNPSR1CNR1
SCHEMBL14410888 0.91 CNR2 (0.52) CNR2CNR1KMT2A
SCHEMBL5451564 0.91 CNR2 (0.52) CNR2CNR1KMT2A
SCHEMBL5444168 0.88 NPSR1 (0.49) CNR2ALDH1A1MAPTNPSR1CNR1
SCHEMBL14411115 0.88 CNR2 (0.54) CNR2CNR1
SCHEMBL14411885 0.88 NPSR1 (0.49) CNR2ALDH1A1MAPTNPSR1CNR1
SCHEMBL5443941 0.88 CNR2 (0.54) CNR2CNR1
SCHEMBL5446550 0.86 ALDH1A1 (0.45) CNR2ALDH1A1MAPTNPSR1CNR1
SCHEMBL5441714 0.85 CNR2 (0.55) CNR2CNR1
SCHEMBL14410920 0.85 CNR2 (0.55) CNR2CNR1

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-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 US disclosed
US-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 US disclosed
US-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-09-13 US 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-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF GIPR, GHSR, GHRHR CNR2 106/4885ALDH1A1 2963/4885MAPT 4523/4885

“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.