SCHEMBL10136877

SCHEMBL10136877

CN(C)S(=O)(=O)c1ccc2c(c1)N(CCCN1CCN(CCCN)CC1)c1ccccc1S2

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 8/20 0.85
DRD2 P14416 8/20 0.85
HRH1 P35367 8/20 0.85
HTR1A P08908 7/20 0.85
ADRA2A P08913 7/20 0.85
SLC6A2 P23975 7/20 0.85
ADRA1A P35348 7/20 0.85
SLC6A3 Q01959 7/20 0.85
KCNH2 Q12809 7/20 0.85
DRD1 P21728 6/20 0.85
ADRA2C P18825 6/20 0.85
HTR2A P28223 6/20 0.85
SLC6A4 P31645 6/20 0.85
CHRM1 P11229 5/20 0.85
ADRA2B P18089 5/20 0.85
CHRM2 P08172 4/20 0.85
OPRM1 P35372 4/20 0.85
HTR2C P28335 4/20 0.85
HRH3 Q9Y5N1 4/20 0.85
PDE4D Q08499 4/20 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
SCHEMBL10136838 0.96 DRD3 (0.85) DRD3DRD2HRH1HTR1AADRA2A
Thioproperazine SCHEMBL29372322 0.92 DRD3 (1.00) DRD3DRD2HRH1HTR1AADRA2A
Thioproperazine SCHEMBL29394708 0.92 DRD3 (1.00) DRD3DRD2HRH1HTR1AADRA2A
Thioproperazine SCHEMBL49902 0.92 DRD3 (1.00) DRD3DRD2HRH1HTR1AADRA2A
SCHEMBL6946497 0.90 DRD3 (0.85) DRD3DRD2HRH1HTR1AADRA2A
SCHEMBL10136896 0.90 DRD2 (0.85) DRD3DRD2HRH1HTR1AADRA2A
Thioproperazine SCHEMBL2386850 0.88 CYP3A4 (1.00) DRD3DRD2HRH1HTR1AADRA2A
Thioproperazine SCHEMBL3027811 0.88 CYP3A4 (1.00) DRD3DRD2HRH1HTR1AADRA2A
Thioproperazine SCHEMBL29888916 0.88 CYP3A4 (1.00) DRD3DRD2HRH1HTR1AADRA2A
SCHEMBL10136823 0.88 DRD3 (0.81) DRD3DRD2HRH1HTR1AADRA2A

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 16 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
WO-2010056979-A1 PHENOTHIAZINE DERIVATIVES FOR TREATMENT OF ASTHMA IMMUNE CONTROL, INC. (US) 2010-05-20 WO 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
WO-2010009332-A1 BINDING AND INHIBITING 5-HT4 RECEPTOR IMMUNE CONTROL, INC. (US) 2010-01-21 WO 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 DRD3 1798/4885DRD2 1397/4885HRH1 14/4885
US-20100035858-A1 Novel Compositions and Methods for Binding and Inhibiting 5-HT4 Receptor HTR4, HTR3B, HTR5A DRD3 356/4885DRD2 254/4885HRH1 338/4885
US-20080132697-A1 Novel compositions for treatment of diseases related to activated lymphocytes NFATC1, CD4, TPH1 DRD3 664/4885DRD2 402/4885HRH1 383/4885
US-20120035161-A1 Novel Compositions and Methods of Treating Diseases Using the Same NFATC1, BAX, BCL2 DRD3 4778/4885DRD2 4807/4885HRH1 1212/4885
US-20080125415-A1 Novel methods for treatment of diseases related to activated lymphocytes HTR5A, TPH1, TPH2 DRD3 468/4885DRD2 358/4885HRH1 286/4885

“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.