SCHEMBL5793366

SCHEMBL5793366

Cc1c[nH]c(CN(C)Cc2ccc3[nH]c(CN4CCCC4)cc3c2)n1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.42
MAP3K11 Q16584 1/20 0.37
HRH3 Q9Y5N1 3/20 0.37
DRD2 P14416 4/20 0.36
DRD3 P35462 4/20 0.36
DRD4 P21917 2/20 0.35
HTR1A P08908 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
OPRK1 P41145 1/20 0.35
CHEK1 O14757 9/20 0.35
SIGMAR1 Q99720 1/20 0.34
CDK7 P50613 3/20 0.34

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
SCHEMBL5796265 0.80 HRH4 (0.46) HRH4MAP3K11HRH3DRD2DRD3
SCHEMBL5793661 0.78 HRH4 (0.43) HRH4HRH3DRD2DRD3DRD4
SCHEMBL5796234 0.77 HRH4 (0.42) HRH4HRH3DRD2DRD3CHEK1
SCHEMBL5797148 0.77 HRH4 (0.41) HRH4HRH3DRD2DRD3DRD4
SCHEMBL5793574 0.76 HRH4 (0.39) HRH4MAP3K11HRH3DRD2DRD3
SCHEMBL5794049 0.75 HRH4 (0.45) HRH4HRH3DRD2DRD3DRD4
SCHEMBL5793372 0.75 HRH4 (0.42) HRH4HRH3DRD2DRD3DRD4
SCHEMBL5917599 0.74 CHEK1 (0.52) HRH4HRH3DRD2DRD3DRD4
SCHEMBL5793998 0.73 HRH4 (0.42) HRH4HRH3DRD2DRD3DRD4
SCHEMBL5794526 0.73 NPC1 (0.53) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006035308-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-04-06 WO claimed
US-20060069087-A1 Histamine-3 receptor antagonists PFIZER INC 2006-03-30 US claimed
WO-2006035308-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-04-06 WO disclosed
US-20060069087-A1 Histamine-3 receptor antagonists PFIZER INC 2006-03-30 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-20060069087-A1 Histamine-3 receptor antagonists HRH3, HRH4, HRH2 HRH4 2/4885MAP3K11 1990/4885HRH3 1/4885

“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.