SCHEMBL6733745

SCHEMBL6733745

C[C@@H]1CCC[C@H](C)N1CCCCN

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.39
HRH2 P25021 1/20 0.39
HRH1 P35367 1/20 0.39
MAOB P27338 1/20 0.39
F10 P00742 1/20 0.36

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
SCHEMBL6733747 1.00 HRH3 (0.39) HRH3HRH2HRH1MAOBF10
SCHEMBL2210788 0.93 HRH3 (0.40) HRH3HRH2HRH1MAOBF10
SCHEMBL2110831 0.93 HRH3 (0.40) HRH3HRH2HRH1MAOBF10
SCHEMBL10505714 0.93 HRH3 (0.40) HRH3HRH2HRH1MAOBF10
SCHEMBL10505725 0.93 HRH3 (0.40) HRH3HRH2HRH1MAOBF10
SCHEMBL855413 0.91 HRH3 (0.36) HRH3HRH2HRH1MAOB
SCHEMBL11199066 0.84 HRH3 (0.37) HRH3HRH2HRH1MAOB
SCHEMBL544481 0.84 LTA4H (0.38) HRH3HRH2HRH1MAOB
SCHEMBL10681465 0.84 LTA4H (0.38) HRH3HRH2HRH1MAOB
SCHEMBL10504563 0.84 LTA4H (0.38) HRH3HRH2HRH1MAOB

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040058905-A1 Immunosuppressants; Alzheimer's diseases; central nervous system disorders; strokes PFIZER INC. 2004-03-25 US disclosed
US-6686357-B1 BENZIMIDAZOLO-PIPERIDINE COMPOUND PFIZER, INC. 2004-02-03 US disclosed
US-6509464-B1 1-Heteroaryl-pyrrolidine, piperidine, or homopiperidine derivates; nervous system disorder treatment; amidation PFIZER INC 2003-01-21 US disclosed
US-6495549-B1 1-HETEROARYL-PIPERIDINE DERIVATIVES; MODERATING NEURONAL DEGENERATION; PROMOTING NEURONAL REGENERATION AND OUTGROWTH; TREATOG NEUROLOGICAL DISORDERS ARISING FROM NEURODEGENERATIVE DISEASES OR OTHER DISORDERS INVOLVING NERVE DAMAGE PFIZER INC 2002-12-17 US disclosed
EP-1098894-B1 FKBP INHIBITORS PFIZER LTD (GB) 2002-10-02 EP disclosed
EP-1098894-A1 FKBP INHIBITORS Pfizer Limited (GB) 2001-05-16 EP disclosed
US-6166011-A FKBP inhibitors PFIZER INC (US) 2000-12-26 US disclosed
WO-2000005231-A1 FKBP INHIBITORS PFIZER LIMITED (GB) 2000-02-03 WO disclosed
US-5034402-A Cerebral insufficiency HOFFMANN-LA ROCHE INC. (US) 1991-07-23 US disclosed
US-4650878-A CEREBRAL INSUFFICIENCY HOFFMANN-LA ROCHE INC. (US) 1987-03-17 US disclosed
EP-0071216-B1 3-HYDROXYPYRROLIDIN-2-ONE DERIVATIVES, PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1986-12-30 EP disclosed
US-4476308-A 1-Pyrrolidine acetamides HOFFMANN-LA ROCHE INC. (US) 1984-10-09 US disclosed
EP-0071216-A2 3-Hydroxypyrrolidin-2-one derivatives, process and intermediates for their preparation and pharmaceutical preparations containing them F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1983-02-09 EP 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-20040058905-A1 Immunosuppressants; Alzheimer's diseases; central nervous system disorders; strokes FKBP1A, FKBP4, FKBP1B HRH3 4785/4885HRH2 4811/4885HRH1 4734/4885

“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.