SCHEMBL10136896

SCHEMBL10136896

CN(C)CCN1CCN(CCCN2c3ccccc3Sc3ccc(S(=O)(=O)N(C)C)cc32)CC1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 10/20 0.85
DRD3 P35462 9/20 0.85
HTR1A P08908 9/20 0.85
HRH1 P35367 9/20 0.85
ADRA2A P08913 8/20 0.85
SLC6A2 P23975 8/20 0.85
ADRA1A P35348 8/20 0.85
KCNH2 Q12809 8/20 0.85
DRD1 P21728 7/20 0.85
SLC6A3 Q01959 7/20 0.85
ADRA2B P18089 7/20 0.85
ADRA2C P18825 7/20 0.85
HTR2A P28223 7/20 0.85
SLC6A4 P31645 7/20 0.85
CHRM1 P11229 6/20 0.85
HTR2C P28335 6/20 0.85
CHRM2 P08172 5/20 0.85
OPRM1 P35372 5/20 0.85
CHRM3 P20309 5/20 0.85
HRH3 Q9Y5N1 3/20 0.85

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
Thioproperazine SCHEMBL29372322 0.92 DRD3 (1.00) DRD2DRD3HTR1AHRH1ADRA2A
Thioproperazine SCHEMBL49902 0.92 DRD3 (1.00) DRD2DRD3HTR1AHRH1ADRA2A
Thioproperazine SCHEMBL29394708 0.92 DRD3 (1.00) DRD2DRD3HTR1AHRH1ADRA2A
SCHEMBL10136838 0.90 DRD3 (0.85) DRD2DRD3HTR1AHRH1ADRA2A
SCHEMBL6946497 0.90 DRD3 (0.85) DRD2DRD3HTR1AHRH1ADRA2A
SCHEMBL10136877 0.90 DRD3 (0.85) DRD2DRD3HTR1AHRH1ADRA2A
Thioproperazine SCHEMBL3027811 0.88 CYP3A4 (1.00) DRD2DRD3HTR1AHRH1ADRA2A
Thioproperazine SCHEMBL2386850 0.88 CYP3A4 (1.00) DRD2DRD3HTR1AHRH1ADRA2A
Thioproperazine SCHEMBL29888916 0.88 CYP3A4 (1.00) DRD2DRD3HTR1AHRH1ADRA2A
SCHEMBL10136823 0.88 DRD3 (0.81) DRD2DRD3HTR1AHRH1ADRA2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120035161-A1 Novel Compositions and Methods of Treating Diseases Using the Same CORRIDOR PHARMACEUTICALS, INC. 2012-02-09 US disclosed
US-20120035161-A1 Novel Compositions and Methods of Treating Diseases Using the Same CORRIDOR PHARMACEUTICALS, INC. 2012-02-09 US disclosed
US-7981885-B2 N-[3-substituted piperazino] alkylphenothiazines; antiproliferative agents, apoptotic agents; 5-HT receptor antagonists IMMUNE CONTROL INC. (US) 2011-07-19 US disclosed
US-7981885-B2 N-[3-substituted piperazino] alkylphenothiazines; antiproliferative agents, apoptotic agents; 5-HT receptor antagonists IMMUNE CONTROL INC. (US) 2011-07-19 US disclosed
US-7923445-B2 10-{3-[4-(2-Amino)ethylpiperazinyl]propyl}2-trifluoromethylphenothiazine and analogues and derivatives; antiproliferative agents; serotonin receptor antagonists; apoptosis in activated lymphocytes, including T, B, and and mylenoma cells; asthma; antiarthritic agents; rheumatic diseeases IMMUNE CONTROL, INC. (US) 2011-04-12 US disclosed
US-7923445-B2 10-{3-[4-(2-Amino)ethylpiperazinyl]propyl}2-trifluoromethylphenothiazine and analogues and derivatives; antiproliferative agents; serotonin receptor antagonists; apoptosis in activated lymphocytes, including T, B, and and mylenoma cells; asthma; antiarthritic agents; rheumatic diseeases IMMUNE CONTROL, INC. (US) 2011-04-12 US disclosed
US-20100130457-A1 Phenothiazine Derivatives for Treatment of Asthma IMMUNE CONTROL, INC. 2010-05-27 US disclosed
US-20100130457-A1 Phenothiazine Derivatives for Treatment of Asthma IMMUNE CONTROL, INC. 2010-05-27 US disclosed
US-20100035858-A1 Novel Compositions and Methods for Binding and Inhibiting 5-HT4 Receptor IMMUNE CONTROL, INC. 2010-02-11 US disclosed
US-20100035858-A1 Novel Compositions and Methods for Binding and Inhibiting 5-HT4 Receptor IMMUNE CONTROL, INC. 2010-02-11 US disclosed
US-20080132697-A1 Novel compositions for treatment of diseases related to activated lymphocytes IMMUNE CONTROL, INC. (US) 2008-06-05 US disclosed
US-20080132697-A1 Novel compositions for treatment of diseases related to activated lymphocytes IMMUNE CONTROL, INC. (US) 2008-06-05 US disclosed
US-20080125415-A1 Novel methods for treatment of diseases related to activated lymphocytes IMMUNE CONTROL, INC. (US) 2008-05-29 US disclosed
US-20080125415-A1 Novel methods for treatment of diseases related to activated lymphocytes IMMUNE CONTROL, INC. (US) 2008-05-29 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 (5 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-20100130457-A1 Phenothiazine Derivatives for Treatment of Asthma IL5, HRH4, TLR5 DRD2 1397/4885DRD3 1798/4885HTR1A 345/4885
US-20100035858-A1 Novel Compositions and Methods for Binding and Inhibiting 5-HT4 Receptor HTR4, HTR3B, HTR5A DRD2 254/4885DRD3 356/4885HTR1A 6/4885
US-20080132697-A1 Novel compositions for treatment of diseases related to activated lymphocytes NFATC1, CD4, TPH1 DRD2 402/4885DRD3 664/4885HTR1A 6/4885
US-20120035161-A1 Novel Compositions and Methods of Treating Diseases Using the Same NFATC1, BAX, BCL2 DRD2 4807/4885DRD3 4778/4885HTR1A 3332/4885
US-20080125415-A1 Novel methods for treatment of diseases related to activated lymphocytes HTR5A, TPH1, TPH2 DRD2 358/4885DRD3 468/4885HTR1A 4/4885

“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.