SCHEMBL5428259

SCHEMBL5428259

Cn1c(CN2CCC(c3c(Cl)cccc3Cl)CC2)cc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.48
FAAH O00519 1/20 0.47
DRD2 P14416 2/20 0.46
DRD4 P21917 2/20 0.46
DRD3 P35462 2/20 0.46
GRM2 Q14416 2/20 0.46
LMNA P02545 2/20 0.43
HCRTR1 O43613 2/20 0.43
HCRTR2 O43614 2/20 0.43
POLB P06746 1/20 0.43
TP53 P04637 3/20 0.42
MAOA P21397 1/20 0.41

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
SCHEMBL5423514 0.87 LMNA (0.45) DRD2LMNAPOLBTP53
SCHEMBL5422744 0.85 POLB (0.47) LMNAPOLBTP53
SCHEMBL5425391 0.84 POLB (0.58) LMNAPOLBTP53
Hydrochloric Acid SCHEMBL5424679 0.84 POLB (0.46) LMNAPOLBTP53
Hydrochloric Acid SCHEMBL5431729 0.83 POLB (0.57) LMNAPOLBTP53
SCHEMBL14375252 0.80 ACHE (0.55) MCHR1FAAH
SCHEMBL5425429 0.79 POLB (0.47) LMNAPOLBTP53
SCHEMBL807593 0.76 FAAH (0.57) MCHR1FAAHHCRTR1HCRTR2
SCHEMBL5419380 0.72 ALDH1A1 (0.46) DRD2DRD4DRD3GRM2
SCHEMBL5427585 0.72 HRH4 (0.56) DRD2DRD4DRD3LMNA

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 MCHR1 28/4885FAAH 1990/4885DRD2 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.