SCHEMBL2070340

SCHEMBL2070340

O[C@@H]1C[C@@H](c2ccccc2)c2ccc(Cl)cc21

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.48
DRD1 P21728 1/20 0.48
CYP19A1 P11511 1/20 0.42
KDM1A O60341 1/20 0.42
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
TRPM4 Q8TD43 2/20 0.40
TRPM5 Q9NZQ8 2/20 0.40
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40

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
SCHEMBL15251759 1.00 DRD2 (0.48) DRD2DRD1CYP19A1KDM1AMAOA
SCHEMBL3671770 1.00 DRD2 (0.48) DRD2DRD1CYP19A1KDM1AMAOA
SCHEMBL29607628 1.00 DRD2 (0.48) DRD2DRD1CYP19A1KDM1AMAOA
SCHEMBL15251760 1.00 DRD2 (0.48) DRD2DRD1CYP19A1KDM1AMAOA
SCHEMBL6055974 1.00 DRD2 (0.48) DRD2DRD1CYP19A1KDM1AMAOA
SCHEMBL13084081 1.00 DRD2 (0.48) DRD2DRD1CYP19A1KDM1AMAOA
SCHEMBL2069258 1.00 DRD2 (0.48) DRD2DRD1CYP19A1KDM1AMAOA
SCHEMBL3803961 1.00 DRD2 (0.48) DRD2DRD1CYP19A1KDM1AMAOA
SCHEMBL5620402 1.00 DRD2 (0.48) DRD2DRD1CYP19A1KDM1AMAOA
SCHEMBL8885782 0.95 DRD2 (0.46) DRD2DRD1CYP19A1KDM1AMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1658276-B1 TRANS-1(6-CHLORO-3-PHENYLINDAN-1-YL)-3,3-DIMETHYLPIPERAZINE LUNDBECK & CO AS H (DK) 2012-10-10 EP disclosed
US-8227607-B2 Processes for 4-((1R,35)-6-Chloro-3-phenylindan-1-yl)-1,2,2-trimethylpiperazine or a salt thereof H. LUNDBECK A/S (DK) 2012-07-24 US disclosed
US-8076342-B2 Malonate salt of 4-((1R,3S)-6-chloro-3-phenylindan-1-yl)-1,2,2-trimethylpiperazine and uses of same H. LUNDBECK A/S (DK) 2011-12-13 US disclosed
US-20110053957-A1 MALONATE SALT OF 4-((1R,3S)-6-CHLORO-3-PHENYLINDAN-1-YL)-1,2,2-TRIMETHYLPIPERAZINE AND USES OF SAME H. LUNDBECK A/S (DK) 2011-03-03 US disclosed
US-20100324291-A1 PROCESSES FOR 4-((1R,3S)-6-CHLORO-3-PHENYLINDAN-1-YL)-1,2,2-TRIMETHYLPIPERAZINE OR A SALT THEREOF H. LUNDBECK A/S (DK) 2010-12-23 US disclosed
US-7772240-B2 used for the treatment of psychological disorders such as schizophrenia, anxiety, depression and bipolar disorder H. LUNDBECK A/S (DK) 2010-08-10 US disclosed
US-7767683-B2 selective serotonin receptor antagonists used for the treatment of psychological disorders such as schizophrenia and bipolar disorders, as anxiolytic agents and antidepressants; improved water solubility; side effect reduction; H. LUNDBECK A/S (DK) 2010-08-03 US disclosed
US-20060281759-A1 selective serotonin receptor antagonists used for the treatment of psychological disorders such as schizophrenia and bipolar disorders, as anxiolytic agents and antidepressants; improved water solubility; side effect reduction; H. LUNDBECK A/S (DK) 2006-12-14 US disclosed
US-20060281758-A1 used for the treatment of psychological disorders such as schizophrenia, anxiety, depression and bipolar disorder H. LUNDBECK A/S (DK) 2006-12-14 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 (4 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-20100324291-A1 PROCESSES FOR 4-((1R,3S)-6-CHLORO-3-PHENYLINDAN-1-YL)-1,2,2-TRIMETHYLPIPERAZINE OR A SALT THEREOF CYP4Z1, HTR3C, HTR1D DRD2 394/4885DRD1 321/4885CYP19A1 3725/4885
US-20060281759-A1 selective serotonin receptor antagonists used for the treatment of psychological disorders such as schizophrenia and bipolar disorders, as anxiolytic agents and antidepressants; improved water solubility; side effect reduction; HTR6, HTR1A, HTR2A DRD2 70/4885DRD1 151/4885CYP19A1 3241/4885
US-20110053957-A1 MALONATE SALT OF 4-((1R,3S)-6-CHLORO-3-PHENYLINDAN-1-YL)-1,2,2-TRIMETHYLPIPERAZINE AND USES OF SAME MAL2, ME1, SYNJ1 DRD2 462/4885DRD1 489/4885CYP19A1 4482/4885
US-20060281758-A1 used for the treatment of psychological disorders such as schizophrenia, anxiety, depression and bipolar disorder DRD2, HTR2C, GABBR1 DRD2 1/4885DRD1 36/4885CYP19A1 3863/4885

“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.