SCHEMBL2783530

SCHEMBL2783530

COCCN1CCN(c2cccc(OC(F)F)c2C)CC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 4/20 0.47
HTR2A P28223 4/20 0.46
HTR7 P34969 3/20 0.46
DRD2 P14416 5/20 0.45
DRD3 P35462 2/20 0.43
HTR6 P50406 3/20 0.43
ADRA1A P35348 3/20 0.43
ADRA1D P25100 2/20 0.43
ADRA1B P35368 2/20 0.43
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
KMT2A Q03164 1/20 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
SCHEMBL2783037 0.88 DRD2 (0.48) HTR1AHTR2AHTR7DRD2DRD3
SCHEMBL2783014 0.87 DRD2 (0.57) HTR1AHTR2AHTR7DRD2DRD3
SCHEMBL2780623 0.86 SLC6A2 (0.51) HTR1AHTR2ADRD2DRD3
SCHEMBL2781257 0.86 DRD2 (0.44) HTR1AHTR2AHTR7DRD2DRD3
SCHEMBL2782561 0.86 DRD2 (0.44) HTR1AHTR2AHTR7DRD2DRD3
SCHEMBL27664416 0.84 DRD2 (0.42) HTR1AHTR2AHTR7DRD2DRD3
SCHEMBL2781924 0.84 HTR6 (0.46) DRD2DRD3HTR6ADRA1AADRA1D
SCHEMBL2781859 0.83 DRD2 (0.49) HTR1AHTR2AHTR7DRD2DRD3
SCHEMBL2781546 0.82 HTR1A (0.47) HTR1AHTR2AHTR7DRD2DRD3
SCHEMBL2783046 0.80 SMN1; SMN2 (0.48) HTR1AHTR2AHTR7DRD2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256163-A1 DISUBSTITUTED PHENYLPIPERDINES/PIPERAZINES AS MODULATORS OF DOPAMINE NEUROTRANSMISSION SANIONA AB (DK) 2010-10-07 US claimed
EP-2204363-A1 New disubstituted phenylpiperidines/piperazines as modulators of dopamine neurotransmission NSAB, Filial af NeuroSearch Sweden AB, Sverige (DK) 2010-07-07 EP claimed
US-20070149542-A1 DISUBSTITUTED PHENYLPIPERIDINES/PIPERAZINES AS MODULATORS OF DOPAMINE NEUROTRANSMISSION SANIONA AB (DK) 2007-06-28 US claimed
US-8314126-B2 Disubstituted phenylpiperdines/piperazines as modulators of dopamine neurotransmission NSAB, FILIAL AF NEUROSEARCH SWEDEN AB, SVERIGE (DK) 2012-11-20 US disclosed
US-20100256163-A1 DISUBSTITUTED PHENYLPIPERDINES/PIPERAZINES AS MODULATORS OF DOPAMINE NEUROTRANSMISSION SANIONA AB (DK) 2010-10-07 US disclosed
US-7763639-B2 Disubstituted phenylpiperidines/piperazines as modulators of dopamine neurotransmission NSAB, FILIAL AF NEUROSEARCH SWEDEN AB, SVERIGE (DK) 2010-07-27 US disclosed
EP-2204363-A1 New disubstituted phenylpiperidines/piperazines as modulators of dopamine neurotransmission NSAB, Filial af NeuroSearch Sweden AB, Sverige (DK) 2010-07-07 EP disclosed
US-20070149542-A1 DISUBSTITUTED PHENYLPIPERIDINES/PIPERAZINES AS MODULATORS OF DOPAMINE NEUROTRANSMISSION SANIONA AB (DK) 2007-06-28 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 (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-20100256163-A1 DISUBSTITUTED PHENYLPIPERDINES/PIPERAZINES AS MODULATORS OF DOPAMINE NEUROTRANSMISSION DRD2, DRD4, DRD1 HTR1A 26/4885HTR2A 16/4885HTR7 146/4885
US-20070149542-A1 DISUBSTITUTED PHENYLPIPERIDINES/PIPERAZINES AS MODULATORS OF DOPAMINE NEUROTRANSMISSION DRD2, DRD4, DRD1 HTR1A 27/4885HTR2A 22/4885HTR7 185/4885

“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.