SCHEMBL10068044

SCHEMBL10068044

O=CNC[C@H]1c2cc(Cl)ccc2Oc2ccccc2[C@@H]1CO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH2 P25021 1/20 0.42
HTR2A P28223 6/20 0.41
HTR2C P28335 6/20 0.41
HRH1 P35367 4/20 0.41
ADRA2A P08913 3/20 0.41
DRD2 P14416 3/20 0.41
ADRA2C P18825 3/20 0.41
DRD1 P21728 3/20 0.41
DRD3 P35462 3/20 0.41
CHRM2 P08172 1/20 0.41
HTR1A P08908 1/20 0.41
GABRA1 P14867 1/20 0.41
ADRA2B P18089 1/20 0.41
DRD4 P21917 1/20 0.41
SLC6A2 P23975 1/20 0.41
ADRA1D P25100 1/20 0.41
SLC6A4 P31645 1/20 0.41
ADRA1A P35348 1/20 0.41
ADRA1B P35368 1/20 0.41
HTR2B P41595 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
SCHEMBL10068226 1.00 HRH2 (0.42) HRH2HTR2AHTR2CHRH1ADRA2A
SCHEMBL15206685 1.00 HRH2 (0.42) HRH2HTR2AHTR2CHRH1ADRA2A
SCHEMBL524818 1.00 HRH2 (0.42) HRH2HTR2AHTR2CHRH1ADRA2A
SCHEMBL15206684 1.00 HRH2 (0.42) HRH2HTR2AHTR2CHRH1ADRA2A
SCHEMBL525678 1.00 HRH2 (0.42) HRH2HTR2AHTR2CHRH1ADRA2A
SCHEMBL15221568 0.86 HTR2A (0.43) HRH2HTR2AHTR2CHRH1ADRA2A
SCHEMBL8170396 0.86 HTR2A (0.51) HRH2HTR2AHTR2CHRH1ADRA2A
SCHEMBL8164477 0.86 HTR2A (0.51) HRH2HTR2AHTR2CHRH1ADRA2A
SCHEMBL15206688 0.84 HTR2A (0.46) HRH2HTR2AHTR2CHRH1ADRA2A
SCHEMBL15206971 0.84 HTR2A (0.46) HRH2HTR2AHTR2CHRH1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2598496-B1 NOVEL PROCESS FOR THE PREPARATION OF ASENAPINE LESVI LABORATORIOS SL (ES) 2014-03-19 EP claimed
US-8653280-B2 Process for the preparation of asenapine Laboratories Lesvi, S.L. (ES) 2014-02-18 US claimed
US-20130225835-A1 NOVEL PROCESS FOR THE PREPARATION OF ASENAPINE LABORATORIOS LESVI, S.L. (ES) 2013-08-29 US claimed
EP-2598496-B1 NOVEL PROCESS FOR THE PREPARATION OF ASENAPINE LESVI LABORATORIOS SL (ES) 2014-03-19 EP disclosed
EP-2598496-B1 NOVEL PROCESS FOR THE PREPARATION OF ASENAPINE LESVI LABORATORIOS SL (ES) 2014-03-19 EP disclosed
US-8653280-B2 Process for the preparation of asenapine Laboratories Lesvi, S.L. (ES) 2014-02-18 US disclosed
US-8653280-B2 Process for the preparation of asenapine Laboratories Lesvi, S.L. (ES) 2014-02-18 US disclosed
US-8653280-B2 Process for the preparation of asenapine Laboratories Lesvi, S.L. (ES) 2014-02-18 US disclosed
US-20130225835-A1 NOVEL PROCESS FOR THE PREPARATION OF ASENAPINE LABORATORIOS LESVI, S.L. (ES) 2013-08-29 US disclosed
US-20130225835-A1 NOVEL PROCESS FOR THE PREPARATION OF ASENAPINE LABORATORIOS LESVI, S.L. (ES) 2013-08-29 US disclosed
US-20130225835-A1 NOVEL PROCESS FOR THE PREPARATION OF ASENAPINE LABORATORIOS LESVI, S.L. (ES) 2013-08-29 US disclosed
WO-2012013766-A1 NOVEL PROCESS FOR THE PREPARATION OF ASENAPINE LABORATORIOS LESVI, S.L. (ES) 2012-02-02 WO 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-20130225835-A1 NOVEL PROCESS FOR THE PREPARATION OF ASENAPINE CYP3A5, ADRB1, ADRA1B HRH2 1500/4885HTR2A 489/4885HTR2C 454/4885

“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.