SCHEMBL5454214

SCHEMBL5454214

COc1ccccc1C1CCN(CCCn2cc(C(C)=O)c3c(OC)cccc32)CC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.52
KMT2A Q03164 6/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HRH2 P25021 3/20 0.47
CACNA1G O43497 1/20 0.46
KCNH2 Q12809 1/20 0.46
MEN1 O00255 5/20 0.46
GRM2 Q14416 1/20 0.46
DRD4 P21917 2/20 0.45
HTR2A P28223 2/20 0.45
HTR2C P28335 2/20 0.45
HTR2B P41595 2/20 0.45
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44

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
SCHEMBL5446820 0.89 SMN1; SMN2 (0.61) DRD2KMT2ASMN1; SMN2HRH2HTR2A
SCHEMBL14411257 0.87 SMN1; SMN2 (0.61) DRD2KMT2ASMN1; SMN2HRH2HTR2A
SCHEMBL5451270 0.85 KCNH2 (0.50) KMT2ASMN1; SMN2KCNH2GRM2HTR2A
SCHEMBL14410967 0.85 DRD2 (0.52) DRD2KMT2ASMN1; SMN2HRH2CACNA1G
SCHEMBL5457453 0.84 HTR4 (0.46) DRD2KMT2ASMN1; SMN2HRH2MEN1
SCHEMBL5454286 0.83 MAPT (0.59) DRD2KMT2ASMN1; SMN2HRH2HTR2A
SCHEMBL5460381 0.83 HRH2 (0.57) DRD2KMT2ASMN1; SMN2HRH2CACNA1G
SCHEMBL5441786 0.83 KMT2A (0.45) KMT2ASMN1; SMN2MEN1ALDH1A1MAPT
SCHEMBL5444486 0.83 HTR2A (0.52) DRD2KMT2ASMN1; SMN2HRH2CACNA1G
SCHEMBL5453899 0.83 KMT2A (0.58) DRD2KMT2ASMN1; SMN2HRH2HTR2A

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 DRD2 2688/4885KMT2A 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.