SCHEMBL5340671

SCHEMBL5340671

COc1cccc2c(C(C)=O)cn(CCCN3CCC(Oc4ccc(F)cc4)CC3)c12

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 13/20 0.51
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CNR1 P21554 5/20 0.43
HTR2A P28223 1/20 0.42
GRM2 Q14416 1/20 0.42

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
SCHEMBL14410854 0.93 CNR2 (0.44) CNR2KMT2ASMN1; SMN2CNR1
SCHEMBL5456447 0.91 CNR2 (0.49) CNR2KMT2ACNR1HTR2AGRM2
SCHEMBL5446783 0.91 HRH2 (0.42) CNR2KMT2ACNR1HTR2A
SCHEMBL5455254 0.90 PRPS1 (0.43) CNR2CNR1HTR2A
SCHEMBL14411850 0.90 PRPS1 (0.43) CNR2CNR1HTR2A
SCHEMBL5453439 0.90 CNR2 (0.49) CNR2KMT2ACNR1
SCHEMBL14464386 0.89 CNR2 (0.39) CNR2HTR2A
SCHEMBL5460386 0.87 CNR2 (0.47) CNR2CNR1
SCHEMBL5441919 0.86 KMT2A (0.43) CNR2KMT2ASMN1; SMN2CNR1HTR2A
SCHEMBL14410851 0.86 CNR2 (0.46) CNR2KMT2ASMN1; SMN2CNR1

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 4 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
WO-2007079239-A2 BICYCLIC NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-07-12 WO disclosed
WO-2007079239-A2 BICYCLIC NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF ACADIA PHARMACEUTICALS INC. (US) 2007-07-12 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-20070213359-A1 BICYCLIC-NITROGEN COMPOUNDS AS MODULATORS OF GHRELIN RECEPTOR AND USES THEREOF GIPR, GHSR, GHRHR CNR2 106/4885KMT2A 4056/4885SMN1; 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.