SCHEMBL403480

SCHEMBL403480

CC(C)(C)OC(=O)N1CCN(CCc2cccc(N)c2)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 6/20 0.53
HTR1A P08908 2/20 0.49
HTR1D P28221 1/20 0.47
HTR1B P28222 1/20 0.47
CHRM2 P08172 1/20 0.46
CHRM4 P08173 1/20 0.46
CHRM1 P11229 1/20 0.46
CHRM3 P20309 1/20 0.46
NR1H2 P55055 1/20 0.46
ACKR3 P25106 2/20 0.46
ADORA2A P29274 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
KCNH2 Q12809 1/20 0.43
GPR119 Q8TDV5 1/20 0.43

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
SCHEMBL266762 0.88 GLS (0.51) CHRM2CHRM4CHRM1CHRM3NR1H2
SCHEMBL14847416 0.86 SIGMAR1 (0.56) SIGMAR1HTR1AHTR1DHTR1BMEN1
SCHEMBL18412526 0.86 SIGMAR1 (0.53) SIGMAR1HTR1AHTR1DHTR1B
SCHEMBL2378962 0.86 SIGMAR1 (0.49) SIGMAR1CHRM2CHRM4CHRM1CHRM3
SCHEMBL4572803 0.85 SIGMAR1 (0.48) SIGMAR1CHRM2CHRM4CHRM1CHRM3
SCHEMBL3712707 0.85 MEN1 (0.59) SIGMAR1CHRM2CHRM4CHRM1CHRM3
SCHEMBL29121436 0.83 KCNH2 (0.54) SIGMAR1HTR1ACHRM2CHRM4CHRM1
SCHEMBL4572801 0.82 SIGMAR1 (0.60) SIGMAR1HTR1AHTR1DHTR1BMEN1
SCHEMBL402901 0.82 SIGMAR1 (0.58) SIGMAR1ACKR3MEN1KMT2AKCNH2
SCHEMBL13724597 0.81 EPHX2 (0.58) CHRM2CHRM4CHRM1CHRM3GPR119

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 83 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12264133-B2 Compounds, compositions and methods CYTOKINETICS, INCORPORATED (US) 2025-04-01 US disclosed
US-20220185779-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED 2022-06-16 US disclosed
US-20210198203-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED 2021-07-01 US disclosed
US-10975034-B2 Compounds, compositions and methods CYTOKINETICS, INC. (US) 2021-04-13 US disclosed
US-20190352267-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED 2019-11-21 US disclosed
US-10385023-B2 Compounds, compositions and methods CYTOKINETICS, INC. (US) 2019-08-20 US disclosed
US-20180305316-A1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED 2018-10-25 US disclosed
US-10035770-B2 Compounds, compositions and methods CYTOKINETICS, INCORPORATED (US) 2018-07-31 US disclosed
EP-2862859-B1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS INC (US) 2018-07-25 EP disclosed
EP-2862859-B1 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS INC (US) 2018-07-25 EP disclosed
US-20070197497-A1 Compounds, compositions and methods CYTOKINETICS, INC. 2007-08-23 US disclosed
US-20070197497-A1 Compounds, compositions and methods CYTOKINETICS, INC. 2007-08-23 US disclosed
WO-2007078839-A2 COMPOUNDS, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2007-07-12 WO disclosed
US-20070161617-A1 Certain chemical entities, compositions and methods CYTOKINETICS, INC. 2007-07-12 US disclosed
US-20070161617-A1 Certain chemical entities, compositions and methods CYTOKINETICS, INC. 2007-07-12 US disclosed
WO-2007075377-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2007-07-05 WO disclosed
WO-2007070626-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2007-06-21 WO disclosed
WO-2007070626-A2 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS CYTOKINETICS, INC. (US) 2007-06-21 WO disclosed
WO-2006009726-A2 SUBSTITUTED UREA DERIVATIVES FOR TREATING CARDIAC DISEASES CYTOKINETICS, INC. (US) 2006-01-26 WO disclosed
US-20060014761-A1 Substituted urea derivatives activate the cardiac sarcomere by potentiating cardiac myosin; systolic heart failure including congestive heart failure; 4-[(3-fluoro-5-{[(6-methyl(3-pyridyl))amino]carbonylamino}-phenyl)methyl]piperazinecarboxylate CYTOKINETICS, INCORPORATED 2006-01-19 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 (11 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-20070161617-A1 Certain chemical entities, compositions and methods TNNI3, TNNT2, MYLK2 SIGMAR1 3079/4885HTR1A 4023/4885HTR1D 4122/4885
US-20060014761-A1 Substituted urea derivatives activate the cardiac sarcomere by potentiating cardiac myosin; systolic heart failure including congestive heart failure; 4-[(3-fluoro-5-{[(6-methyl(3-pyridyl))amino]carbonylamino}-phenyl)methyl]piperazinecarboxylate TNNI3, MYLK2, TNNT2 SIGMAR1 3322/4885HTR1A 2635/4885HTR1D 2382/4885
US-10385023-B2 Compounds, compositions and methods TNNI3, TNNC1, TNNT2 SIGMAR1 3801/4885HTR1A 3992/4885HTR1D 3741/4885
US-20220185779-A1 COMPOUNDS, COMPOSITIONS AND METHODS TNNI3, TNNC1, TNNT2 SIGMAR1 3801/4885HTR1A 3992/4885HTR1D 3741/4885
US-12264133-B2 Compounds, compositions and methods TNNI3, TNNC1, TNNT2 SIGMAR1 3801/4885HTR1A 3992/4885HTR1D 3741/4885
US-20190352267-A1 COMPOUNDS, COMPOSITIONS AND METHODS TNNI3, TNNC1, TNNT2 SIGMAR1 3801/4885HTR1A 3992/4885HTR1D 3741/4885
US-20070197497-A1 Compounds, compositions and methods TNNI3, TNNC1, TNNT2 SIGMAR1 3801/4885HTR1A 3992/4885HTR1D 3741/4885
US-10975034-B2 Compounds, compositions and methods TNNI3, TNNC1, TNNT2 SIGMAR1 3801/4885HTR1A 3992/4885HTR1D 3741/4885
US-10035770-B2 Compounds, compositions and methods TNNI3, TNNC1, TNNT2 SIGMAR1 3801/4885HTR1A 3992/4885HTR1D 3741/4885
US-20180305316-A1 COMPOUNDS, COMPOSITIONS AND METHODS TNNI3, TNNC1, TNNT2 SIGMAR1 3801/4885HTR1A 3992/4885HTR1D 3741/4885
US-20210198203-A1 COMPOUNDS, COMPOSITIONS AND METHODS TNNI3, TNNC1, TNNT2 SIGMAR1 3801/4885HTR1A 3992/4885HTR1D 3741/4885

“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.