SCHEMBL3263185

SCHEMBL3263185

c1ccc2c(C3CC[N]CC3)noc2c1

nearest known ligand 0.65

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 14/20 0.44
HTR2A P28223 14/20 0.44
HTR1A P08908 12/20 0.44
HTR7 P34969 2/20 0.42

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
SCHEMBL23175425 0.89 DRD2 (0.46) DRD2HTR2AHTR1AHTR7
SCHEMBL12026856 0.84 HIF1A (0.49) DRD2HTR2AHTR1AHTR7
SCHEMBL373467 0.81 BCHE (0.44) DRD2HTR2AHTR1A
SCHEMBL5995383 0.80 BCHE (0.43) DRD2HTR2AHTR1AHTR7
Hydrochloric Acid SCHEMBL1545403 0.80 BCHE (0.43) DRD2HTR2AHTR1A
SCHEMBL10637150 0.79 DRD2 (0.50) DRD2HTR2AHTR1AHTR7
SCHEMBL10637706 0.79 DRD2 (0.55) DRD2HTR2AHTR1AHTR7
SCHEMBL15033122 0.79 DRD2 (0.48) DRD2HTR2AHTR1AHTR7
Hydrochloric Acid SCHEMBL10638213 0.78 DRD2 (0.54) DRD2HTR2AHTR1AHTR7
SCHEMBL2197968 0.78 ACHE (0.62) DRD2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 US claimed
EP-2183245-B1 DUAL MODULATORS OF 5-HT2A AND D3 RECEPTORS HOFFMANN LA ROCHE (CH) 2014-07-09 EP disclosed
EP-2183245-A2 DUAL MODULATORS OF 5-HT2A AND D3 RECEPTORS F. Hoffmann-Roche AG (CH) 2010-05-12 EP disclosed
US-20090029977-A1 DUAL MODULATORS OF 5HT2A AND D3 RECEPTORS F. HOFFMANN-LA ROCHE AG (CH) 2009-01-29 US disclosed
WO-2009013212-A2 DUAL MODULATORS OF 5-HT2A AND D3 RECEPTORS F. HOFFMANN-LA ROCHE AG (CH) 2009-01-29 WO disclosed
US-5691330-A ANTIPSYCHOTIC AGENT YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1997-11-25 US disclosed
US-5532240-A ANTIPSYCHOTIC AGENTS AND ANTISEROTONIN AGENTS YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1996-07-02 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-20090029977-A1 DUAL MODULATORS OF 5HT2A AND D3 RECEPTORS HTR2A, HTR3A, HTR1A DRD2 6/4885HTR2A 1/4885HTR1A 3/4885

“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.