SCHEMBL14410883

SCHEMBL14410883

COc1cccc2c(C(C)=O)cn(CCCN3CCCN(Cc4ccc(F)cc4)CC3)c12

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 7/20 0.56
POLB P06746 1/20 0.47
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
DRD3 P35462 1/20 0.44
MAPK1 P28482 1/20 0.43
CNR1 P21554 3/20 0.43
SLC29A1 Q99808 1/20 0.43

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
SCHEMBL5444412 0.91 CNR2 (0.51) CNR2POLBKMT2ASMN1; SMN2CNR1
SCHEMBL5454795 0.90 POLB (0.48) CNR2POLBCNR1
SCHEMBL5446660 0.90 POLB (0.48) CNR2POLBCNR1
SCHEMBL5453889 0.89 CNR2 (0.53) CNR2DRD3MAPK1CNR1SLC29A1
SCHEMBL14410882 0.89 CNR2 (0.53) CNR2KMT2ASMN1; SMN2DRD3CNR1
SCHEMBL5444504 0.89 POLB (0.47) CNR2POLBMAPK1
SCHEMBL5444363 0.89 POLB (0.47) CNR2POLBCNR1
SCHEMBL5454615 0.89 CNR2 (0.67) CNR2POLBKMT2AMAPK1SLC29A1
SCHEMBL14410865 0.86 CNR2 (0.46) CNR2KMT2ASMN1; SMN2CNR1
SCHEMBL5459842 0.86 CNR2 (0.50) CNR2DRD3CNR1

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 2 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

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 106/4885POLB 4520/4885KMT2A 4056/4885

“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.