SCHEMBL5455713

SCHEMBL5455713

CCc1cccc2c(C(=O)NCc3ccc(Cl)c(Cl)c3)cn(CCCN3CCN(CC(=O)N4CCOCC4)CC3)c12

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.49
CNR1 P21554 4/20 0.43
CNR2 P34972 3/20 0.43
KMT2A Q03164 1/20 0.41
F2 P00734 1/20 0.39
PDE10A Q9Y233 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
ENPP2 Q13822 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
HPGD P15428 1/20 0.39

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
SCHEMBL5456424 0.90 CNR2 (0.51) CNR1CNR2KMT2APDE10ANPC1
SCHEMBL5473116 0.90 LMNA (0.53) LMNACNR1CNR2PDE10AHPGD
SCHEMBL5446417 0.88 CNR2 (0.46) CNR1CNR2KMT2AENPP2
SCHEMBL5454687 0.86 CNR1 (0.49) LMNACNR1CNR2KMT2ASIGMAR1
SCHEMBL5446718 0.84 CNR1 (0.47) LMNACNR1CNR2SIGMAR1
SCHEMBL5446546 0.84 CNR1 (0.47) CNR1CNR2HPGD
SCHEMBL5451250 0.84 CNR1 (0.43) CNR1CNR2KMT2AF2PDE10A
SCHEMBL5453053 0.83 PTPN7 (0.47) CNR1CNR2
SCHEMBL5462847 0.83 CNR1 (0.43) CNR1CNR2PDE10AENPP2
SCHEMBL5453064 0.82 DRD3 (0.43) CNR1CNR2KMT2AF2

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 LMNA 3791/4885CNR1 65/4885CNR2 106/4885

“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.