SCHEMBL5417469

SCHEMBL5417469

Fc1cccc(C2CCN(Cc3c(-c4ccccc4)[nH]c4ccccc34)CC2)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 8/20 0.53
TLR9 Q9NR96 3/20 0.48
DRD2 P14416 6/20 0.46
DRD4 P21917 1/20 0.46
DRD3 P35462 1/20 0.46
HTR2C P28335 5/20 0.46
KCNH2 Q12809 2/20 0.46
TLR7 Q9NYK1 2/20 0.45
TLR8 Q9NR97 1/20 0.45
CCR5 P51681 1/20 0.44
CHRM4 P08173 1/20 0.44
GRIN2B Q13224 1/20 0.44
POLB P06746 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
SCHEMBL5424647 0.89 HTR2A (0.62) HTR2ATLR9DRD2DRD4DRD3
SCHEMBL5417422 0.88 HTR2A (0.56) HTR2ATLR9DRD2DRD4DRD3
SCHEMBL5415363 0.88 HTR2A (0.53) HTR2ADRD2DRD4DRD3HTR2C
SCHEMBL5420662 0.87 HTR2A (0.53) HTR2ATLR9DRD2DRD4DRD3
SCHEMBL5431724 0.87 HTR2A (0.56) HTR2ATLR9DRD2DRD4DRD3
SCHEMBL4710595 0.83 HTR2A (0.62) HTR2ATLR9DRD2HTR2CKCNH2
SCHEMBL5427628 0.81 MEN1 (0.59) HTR2ADRD2DRD4DRD3HTR2C
SCHEMBL5425718 0.81 HTR2A (0.59) HTR2ATLR9DRD2DRD4DRD3
SCHEMBL5425794 0.81 HTR2A (0.56) HTR2ADRD2DRD3HTR2CKCNH2
SCHEMBL5419288 0.80 HTR2A (0.53) HTR2ATLR9DRD2DRD4DRD3

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-20070197603-A1 Substituted indole ligands for the orl-1 receptor GLAXOSMITHKLINE S.P.A. (IT) 2007-08-23 US claimed
US-20070197603-A1 Substituted indole ligands for the orl-1 receptor GLAXOSMITHKLINE S.P.A. (IT) 2007-08-23 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-20070197603-A1 Substituted indole ligands for the orl-1 receptor OGFRL1, OPRL1, ORMDL3 HTR2A 147/4885TLR9 715/4885DRD2 99/4885

“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.