SCHEMBL5165935

SCHEMBL5165935

CN(C)C1CCN(Cc2ccc(-c3ccccc3)cc2)C1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.63
LTA4H P09960 1/20 0.58
CHRM4 P08173 2/20 0.57
CYP2D6 P10635 1/20 0.53
HRH3 Q9Y5N1 2/20 0.51
MEN1 O00255 1/20 0.51
POLB P06746 1/20 0.51
KMT2A Q03164 1/20 0.51
KCNH2 Q12809 1/20 0.50
JAK2 O60674 1/20 0.49
MCHR1 Q99705 1/20 0.49
CCR5 P51681 1/20 0.48
ATM Q13315 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
DRD2 P14416 1/20 0.48
DRD4 P21917 1/20 0.48

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
SCHEMBL13024536 0.91 LTA4H (0.60) HDAC1LTA4HCHRM4CYP2D6DRD2
SCHEMBL1911332 0.91 LTA4H (0.60) HDAC1LTA4HCHRM4CYP2D6DRD2
SCHEMBL13634431 0.91 LTA4H (0.60) HDAC1LTA4HCHRM4CYP2D6DRD2
SCHEMBL5167686 0.90 LTA4H (0.56) HDAC1LTA4HCHRM4CYP2D6HRH3
SCHEMBL5164995 0.87 HDAC1 (0.53) HDAC1LTA4HCHRM4CYP2D6HRH3
SCHEMBL5166411 0.87 GRM2 (0.56) HDAC1LTA4HCHRM4CYP2D6HRH3
SCHEMBL5165601 0.87 HDAC1 (0.56) HDAC1LTA4HCHRM4CYP2D6HRH3
SCHEMBL5167418 0.86 NPC1 (0.59) HDAC1LTA4HHRH3MEN1KMT2A
SCHEMBL5191116 0.86 LSS (0.52) HDAC1LTA4HCHRM4HRH3MEN1
SCHEMBL5188483 0.86 LSS (0.52) HDAC1LTA4HCHRM4HRH3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1771438-A1 1-3 SUBSTITUTED CYCLOAMINO DERIVATIVES AND THEIR USE AS HISTAMINE-3 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2007-04-11 EP claimed
WO-2006011042-A1 1, 3 SUBSTITUTED CYCLOAMINO DERIVATIVES AND THEIR USE AS HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-02-02 WO claimed
US-20060014733-A1 Histamine-3 agonists and antagonists PFIZER INC 2006-01-19 US claimed
EP-1771438-A1 1-3 SUBSTITUTED CYCLOAMINO DERIVATIVES AND THEIR USE AS HISTAMINE-3 RECEPTOR ANTAGONISTS Pfizer Products Incorporated (US) 2007-04-11 EP disclosed
WO-2006011042-A1 1, 3 SUBSTITUTED CYCLOAMINO DERIVATIVES AND THEIR USE AS HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-02-02 WO disclosed
US-20060014733-A1 Histamine-3 agonists and antagonists PFIZER INC 2006-01-19 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-20060014733-A1 Histamine-3 agonists and antagonists HRH3, HRH4, HRH2 HDAC1 1532/4885LTA4H 395/4885CHRM4 209/4885

“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.