SCHEMBL5457612

SCHEMBL5457612

CON(C)C(=O)c1cn(CCCN2CCN(CCN(C(C)C)C(C)C)CC2)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.46
CNR1 P21554 11/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
KMT2A Q03164 1/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
ADRA1D P25100 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
SCHEMBL5451251 0.90 CNR2 (0.50) CNR2CNR1SMN1; SMN2KMT2AALDH1A1
SCHEMBL5453757 0.88 NR4A2 (0.54) CNR2CNR1SMN1; SMN2KMT2AALDH1A1
SCHEMBL5456434 0.86 CNR2 (0.51) CNR2CNR1SMN1; SMN2KMT2AALDH1A1
SCHEMBL5448762 0.86 SMN1; SMN2 (0.56) CNR2CNR1SMN1; SMN2KMT2AALDH1A1
SCHEMBL5454223 0.84 CNR2 (0.48) CNR2CNR1SMN1; SMN2KMT2AALDH1A1
SCHEMBL5445041 0.84 CNR2 (0.48) CNR2CNR1SMN1; SMN2KMT2AALDH1A1
SCHEMBL14412214 0.84 DRD3 (0.50) CNR2CNR1SMN1; SMN2ALDH1A1ADRA1D
SCHEMBL5451043 0.82 HTR1A (0.51) CNR2ADRA1D
Hydrochloric Acid SCHEMBL5454205 0.81 ADRA1D (0.55) CNR2ADRA1D
SCHEMBL5448948 0.81 CNR2 (0.47) CNR2CNR1ADRA1D

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 1 patent. 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

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 106/4885CNR1 65/4885SMN1; SMN2 1701/4885

“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.