SCHEMBL5824293

SCHEMBL5824293

Cc1n[nH]c(C)c1C(C)N(Cc1ccc2[nH]c(CN3CCCC3)cc2c1)C1CC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 1/20 0.37
CHEK1 O14757 9/20 0.35
CDK7 P50613 8/20 0.35
DRD2 P14416 6/20 0.34
DRD3 P35462 6/20 0.34
DRD4 P21917 3/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
OPRK1 P41145 1/20 0.33
HRH3 Q9Y5N1 1/20 0.32
ILK Q13418 1/20 0.32

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
SCHEMBL5824172 0.86 HRH4 (0.39) HRH4CHEK1CDK7DRD2DRD3
SCHEMBL5796265 0.73 HRH4 (0.46) HRH4CHEK1CDK7DRD2DRD3
SCHEMBL5818357 0.72 HRH3 (0.41) DRD2DRD3DRD4HRH3
SCHEMBL5793271 0.72 MEN1 (0.43) HRH4CHEK1DRD2DRD3HRH3
SCHEMBL5917599 0.69 CHEK1 (0.52) HRH4CHEK1CDK7DRD2DRD3
SCHEMBL5823581 0.69 KDM4E (0.41) HRH4CHEK1DRD2DRD3DRD4
SCHEMBL5809818 0.66 KMT2A (0.42) HRH4CHEK1CDK7DRD2DRD3
SCHEMBL5793998 0.66 HRH4 (0.42) HRH4CHEK1DRD2DRD3DRD4
SCHEMBL5793366 0.66 HRH4 (0.42) HRH4CHEK1CDK7DRD2DRD3
SCHEMBL5793372 0.66 HRH4 (0.42) HRH4CHEK1CDK7DRD2DRD3

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
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 2/4885CHEK1 2994/4885CDK7 1954/4885

“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.