SCHEMBL5794513

SCHEMBL5794513

CCN(CCO)Cc1ccc2[nH]c(CN3CCCC3)cc2c1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.46
DRD3 P35462 5/20 0.46
HRH3 Q9Y5N1 7/20 0.43
HRH4 Q9H3N8 1/20 0.43
ALDH1A1 P00352 2/20 0.37
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
STAT3 P40763 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
ALOX15 P16050 1/20 0.37
CHEK1 O14757 2/20 0.36
DRD4 P21917 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 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
SCHEMBL5796831 0.80 CHRNB2 (0.46) DRD2DRD3HRH3HRH4ALDH1A1
SCHEMBL5793647 0.79 HRH4 (0.47) DRD2DRD3HRH3HRH4ALDH1A1
SCHEMBL5917599 0.78 CHEK1 (0.52) DRD2DRD3HRH3HRH4ALDH1A1
SCHEMBL5823680 0.72 HRH4 (0.41) DRD2DRD3HRH3HRH4ALDH1A1
SCHEMBL5793515 0.72 HRH3 (0.45) DRD3HRH3HRH4ALDH1A1KMT2A
SCHEMBL5796117 0.71 CHEK1 (0.58) HRH3HRH4ALDH1A1KMT2AKDM4E
SCHEMBL5917611 0.71 CHEK1 (0.46) HRH3HRH4ALDH1A1KMT2APOLB
SCHEMBL5917615 0.71 HRH3 (0.52) DRD2DRD3HRH3HRH4ALDH1A1
SCHEMBL5796265 0.71 HRH4 (0.46) DRD2DRD3HRH3HRH4ALDH1A1
SCHEMBL5793372 0.70 HRH4 (0.42) DRD2DRD3HRH3HRH4KDM4E

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 DRD2 128/4885DRD3 92/4885HRH3 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.