SCHEMBL2786147

SCHEMBL2786147

C1=C(c2ccc3oc(CCCN4CCCC4)cc3c2)COCC1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 16/20 0.50
DRD2 P14416 3/20 0.41
DRD1 P21728 2/20 0.41
DRD3 P35462 2/20 0.41
DRD5 P21918 1/20 0.41
ESR1 P03372 1/20 0.39
ESRRG P62508 1/20 0.39
HTR2B P41595 1/20 0.38

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
SCHEMBL2786149 0.79 HRH3 (0.63) HRH3
SCHEMBL2785130 0.77 DRD2 (0.39) HRH3DRD2DRD1DRD3DRD5
SCHEMBL29175059 0.72 DRD2 (0.68) HRH3DRD2DRD1DRD3DRD5
SCHEMBL30628624 0.72 DRD2 (0.68) HRH3DRD2DRD1DRD3DRD5
SCHEMBL2786314 0.70 HRH3 (0.53) HRH3
SCHEMBL2785064 0.67 HRH3 (1.00) HRH3
SCHEMBL2784785 0.66 HRH3 (1.00) HRH3
SCHEMBL2786737 0.66 HRH3 (1.00) HRH3
SCHEMBL7597675 0.66 HRH3 (0.98) HRH3
SCHEMBL2785133 0.65 HRH3 (1.00) HRH3

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
EP-2258694-A1 Amines as histamine-3 receptor ligands and their therapeutic applications Abbott Laboratories (US) 2010-12-08 EP claimed
US-7538138-B2 Amines as histamine-3 receptor ligands and their therapeutic applications ABBOTT LABORATORIES (US) 2009-05-26 US claimed
US-20050192277-A1 Novel amines as histamine-3 receptor ligands and their therapeutic applications ABBVIE INC. 2005-09-01 US claimed
US-20020169188-A1 Novel amines as histamine-3 receptor ligands and their therapeutic applications ABBVIE INC. 2002-11-14 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20050192277-A1 Novel amines as histamine-3 receptor ligands and their therapeutic applications HRH3, HRH4, HRH2 HRH3 1/4885DRD2 899/4885DRD1 1552/4885
US-20020169188-A1 Novel amines as histamine-3 receptor ligands and their therapeutic applications HRH3, HRH4, HRH1 HRH3 1/4885DRD2 999/4885DRD1 1255/4885

“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.