SCHEMBL3324632

SCHEMBL3324632

N#Cc1ccc(C2CCN(Cc3ccccc3)CC2)[c]n1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.48
ACHE P22303 5/20 0.48
CCR3 P51677 1/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
DRD2 P14416 5/20 0.43
DRD4 P21917 4/20 0.43
DRD3 P35462 4/20 0.43
SIGMAR1 Q99720 1/20 0.41
THRB P10828 1/20 0.41

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
SCHEMBL2821846 0.77 DRD2 (0.50) HRH3ACHECCR3MEN1KMT2A
SCHEMBL311417 0.72 ACHE (0.61) HRH3ACHECCR3DRD2DRD4
SCHEMBL7238995 0.70 HRH3 (0.65) HRH3ACHECCR3MEN1KMT2A
Hydrochloric Acid SCHEMBL312187 0.70 ACHE (0.59) HRH3ACHECCR3DRD2DRD4
Hydrochloric Acid SCHEMBL10625447 0.69 HRH3 (0.64) HRH3ACHECCR3MEN1KMT2A
SCHEMBL2822514 0.69 ACHE (0.67) HRH3ACHEKMT2ATHRB
SCHEMBL13490679 0.68 HRH3 (0.55) HRH3ACHEDRD2DRD4DRD3
SCHEMBL27759412 0.68 CHRM4 (0.50)
SCHEMBL1002852 0.68 MEN1 (0.81) ACHECCR3MEN1KMT2ADRD2
SCHEMBL8844616 0.68 ACHE (0.48) HRH3ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100137368-A1 PYRIDINE DERIVATIVES AS FAST DISSOCIATING DOPAMINE 2 RECEPTOR ANTAGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2010-06-03 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-20100137368-A1 PYRIDINE DERIVATIVES AS FAST DISSOCIATING DOPAMINE 2 RECEPTOR ANTAGONISTS DRD2, GRIN2C, GRIN2A HRH3 554/4885ACHE 214/4885CCR3 4440/4885

“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.