SCHEMBL5773436

SCHEMBL5773436

CN1C[C@@H]2CN(C(=O)c3cc4ccc(Cl)cc4[nH]3)C[C@@H]2C1

nearest known ligand 0.82

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 15/20 0.82
HRH3 Q9Y5N1 3/20 0.82
HRH1 P35367 1/20 0.57
GPR183 P32249 2/20 0.53
DRD2 P14416 1/20 0.52
DRD3 P35462 1/20 0.52
ALOX15 P16050 1/20 0.51

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
SCHEMBL5772286 0.90 HRH4 (1.00) HRH4HRH3HRH1
SCHEMBL2166664 0.90 HRH4 (1.00) HRH4HRH3HRH1
SCHEMBL5770771 0.86 HRH4 (0.65) HRH4HRH3DRD2DRD3
SCHEMBL605738 0.83 HRH4 (1.00) HRH4HRH3HRH1GPR183DRD2
SCHEMBL5774343 0.79 HRH4 (0.76) HRH4HRH3
SCHEMBL5776243 0.79 HRH4 (0.76) HRH4HRH3HRH1
SCHEMBL17310792 0.78 HRH4 (0.55) HRH4HRH3HRH1GPR183DRD2
SCHEMBL21323221 0.78 HRH4 (0.55) HRH4HRH3HRH1GPR183DRD2
SCHEMBL5773503 0.78 HRH4 (0.83) HRH4HRH3ALOX15
SCHEMBL5775604 0.78 HRH4 (0.63) HRH4HRH3

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
EP-1671972-A1 Octahydropyrrolo[3,4-c]pyrrole derivatives Pfizer Limited (GB) 2006-06-21 EP claimed
EP-1671972-A1 Octahydropyrrolo[3,4-c]pyrrole derivatives Pfizer Limited (GB) 2006-06-21 EP disclosed
US-20060111416-A1 Octahydropyrrolo[3,4-C]pyrrole derivatives PFIZER INC. 2006-05-25 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-20060111416-A1 Octahydropyrrolo[3,4-C]pyrrole derivatives DPYD, PAH, DHPS HRH4 1986/4885HRH3 3821/4885HRH1 2994/4885

“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.