SCHEMBL19256449

SCHEMBL19256449

O=C(OCc1ccccc1)OCN1CC2c3ccccc3Oc3ccc(Cl)cc3C2C1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 1/20 0.55
DRD2 P14416 5/20 0.53
DRD3 P35462 5/20 0.53
HTR2A P28223 5/20 0.53
HTR2C P28335 5/20 0.53
ADRA2A P08913 3/20 0.53
ADRA2C P18825 3/20 0.53
DRD1 P21728 3/20 0.53
HRH1 P35367 3/20 0.53
CHRM2 P08172 1/20 0.53
HTR1A P08908 1/20 0.53
GABRA1 P14867 1/20 0.53
ADRA2B P18089 1/20 0.53
DRD4 P21917 1/20 0.53
SLC6A2 P23975 1/20 0.53
ADRA1D P25100 1/20 0.53
SLC6A4 P31645 1/20 0.53
ADRA1A P35348 1/20 0.53
ADRA1B P35368 1/20 0.53
HTR2B P41595 1/20 0.53

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
SCHEMBL19256735 0.88 HTR2A (0.58) HRH2DRD2DRD3HTR2AHTR2C
SCHEMBL19256094 0.87 HRH2 (0.56) HRH2DRD2DRD3HTR2AHTR2C
SCHEMBL19256257 0.85 HTR2A (0.62) HRH2DRD2DRD3HTR2AHTR2C
SCHEMBL19256453 0.85 HRH2 (0.58) HRH2DRD2DRD3HTR2AHTR2C
SCHEMBL19256736 0.84 HRH2 (0.53) HRH2DRD2DRD3HTR2AHTR2C
SCHEMBL19256097 0.84 HTR2A (0.54) HRH2DRD2DRD3HTR2AHTR2C
SCHEMBL19256738 0.84 HTR2A (0.56) HRH2DRD2DRD3HTR2AHTR2C
SCHEMBL19256003 0.83 HTR2A (0.57) HRH2DRD2DRD3HTR2AHTR2C
SCHEMBL19256274 0.82 HTR2A (0.59) HRH2DRD2DRD3HTR2AHTR2C
SCHEMBL19256259 0.82 HTR2A (0.58) HRH2DRD2DRD3HTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2521711-B1 QUATERNARY AMMONIUM SALT PRODRUGS ALKERMES PHARMA IRELAND LTD (IE) 2017-08-16 EP disclosed
US-20150307458-A1 Deuterated 1-piperazino-3-phenyl indanes for treatment of schizophrenia H. LUNDBECK A/S (DK) 2015-10-29 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-20150307458-A1 Deuterated 1-piperazino-3-phenyl indanes for treatment of schizophrenia HTR2C, DRD2, HTR2A HRH2 78/4885DRD2 2/4885DRD3 5/4885

“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.