SCHEMBL5772717

SCHEMBL5772717

CC(C)N1C[C@H]2CN(C(=O)c3cc4cc(Cl)ccc4[nH]3)C[C@H]2C1

nearest known ligand 0.77

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 10/20 0.77
HRH3 Q9Y5N1 6/20 0.77
HRH1 P35367 1/20 0.60
KMT2A Q03164 7/20 0.55
MEN1 O00255 5/20 0.53
RAB9A P51151 1/20 0.53
ATM Q13315 1/20 0.53
RXFP1 Q9HBX9 1/20 0.52
POLB P06746 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 0.87 HRH4 (1.00) HRH4HRH3HRH1KMT2AMEN1
SCHEMBL2166664 0.87 HRH4 (1.00) HRH4HRH3HRH1KMT2AMEN1
SCHEMBL5773372 0.84 HRH4 (0.77) HRH4HRH3HRH1KMT2AMEN1
SCHEMBL13815897 0.83 HRH4 (0.76) HRH4HRH3HRH1KMT2AMEN1
SCHEMBL5775848 0.83 HRH4 (0.76) HRH4HRH3HRH1KMT2AMEN1
SCHEMBL5775412 0.82 HRH4 (0.84) HRH4HRH3
SCHEMBL17938630 0.78 HRH4 (0.86) HRH4HRH3HRH1KMT2AMEN1
SCHEMBL5773436 0.77 HRH4 (0.82) HRH4HRH3HRH1
SCHEMBL4324848 0.77 HRH4 (0.69) HRH4HRH3HRH1KMT2AMEN1
SCHEMBL4324398 0.77 HRH4 (0.69) HRH4HRH3HRH1KMT2AMEN1

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.