SCHEMBL5452512

SCHEMBL5452512

CCC(=O)c1cn(CCCN2CCC(S(=O)(=O)c3ccc(Cl)cc3)CC2)c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.51
L3MBTL1 Q9Y468 1/20 0.46
CNR1 P21554 3/20 0.46
KMT2A Q03164 2/20 0.44
HTR2A P28223 3/20 0.43
DRD2 P14416 2/20 0.43
KCNH2 Q12809 2/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.42
HTR2C P28335 1/20 0.41
TP53 P04637 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
SCHEMBL14411613 0.91 CNR2 (0.48) CNR2CNR1KMT2AHTR2ADRD2
Hydrochloric Acid SCHEMBL5451424 0.90 CNR2 (0.47) CNR2CNR1KMT2AHTR2ADRD2
SCHEMBL5456404 0.86 KDM4E (0.45) CNR2CNR1HTR2ADRD2KCNH2
SCHEMBL14412022 0.85 CNR2 (0.47) CNR2CNR1HTR2ADRD2KCNH2
Hydrochloric Acid SCHEMBL5452031 0.85 CNR2 (0.43) CNR2CNR1HTR2ADRD2KCNH2
SCHEMBL5452863 0.79 KCNH2 (0.57) CNR2L3MBTL1CNR1KMT2AHTR2A
SCHEMBL5450012 0.78 CNR1 (0.56) CNR2L3MBTL1CNR1KMT2ADRD2
SCHEMBL14411153 0.77 KMT2A (0.50) CNR2L3MBTL1CNR1KMT2AMEN1
SCHEMBL5452082 0.77 L3MBTL1 (0.57) CNR2L3MBTL1CNR1KMT2AKCNH2
SCHEMBL5451082 0.76 MAPK1 (0.60) CNR2L3MBTL1CNR1KMT2AMEN1

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 106/4885L3MBTL1 4494/4885CNR1 65/4885

“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.