SCHEMBL7714031

SCHEMBL7714031

CCOC(=O)CCCCN(C)c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.61
ALOX5 P09917 1/20 0.53
CYP4F2 P78329 2/20 0.52
CYP4A11 Q02928 2/20 0.52
ALDH1A1 P00352 3/20 0.51
LTA4H P09960 3/20 0.51
MAPK1 P28482 1/20 0.47
KMT2A Q03164 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
TOP2A P11388 1/20 0.46
HTT P42858 1/20 0.46
TP53 P04637 1/20 0.45
TNF P01375 1/20 0.45
POLB P06746 1/20 0.45
TBXAS1 P24557 3/20 0.44

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
SCHEMBL8993951 0.98 SMN1; SMN2 (0.60) SMN1; SMN2ALOX5CYP4F2CYP4A11ALDH1A1
SCHEMBL8993937 0.95 SMN1; SMN2 (0.63) SMN1; SMN2ALOX5CYP4F2CYP4A11ALDH1A1
SCHEMBL2405898 0.90 SMN1; SMN2 (0.65) SMN1; SMN2ALOX5CYP4F2CYP4A11ALDH1A1
SCHEMBL9746067 0.85 DNM1 (0.54) SMN1; SMN2ALDH1A1LTA4HKMT2ATDP1
SCHEMBL8993953 0.85 CYP1A2 (0.45) SMN1; SMN2ALOX5CYP4F2CYP4A11ALDH1A1
SCHEMBL31478350 0.84 LMNA (0.50) SMN1; SMN2ALDH1A1LTA4HKMT2A
SCHEMBL31478356 0.84 LMNA (0.50) SMN1; SMN2ALDH1A1LTA4HKMT2A
SCHEMBL31478349 0.84 LMNA (0.50) SMN1; SMN2ALDH1A1LTA4HKMT2A
SCHEMBL7712007 0.84 KMT2A (0.49) SMN1; SMN2ALOX5CYP4F2CYP4A11ALDH1A1
SCHEMBL8993978 0.84 CYP1A2 (0.44) SMN1; SMN2ALOX5CYP4F2CYP4A11ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9720004-B2 Immunoassays employing non-particulate chemiluminescent reagent SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2017-08-01 US disclosed
US-20160231336-A1 IMMUNOASSAYS EMPLOYING NON-PARTICULATE CHEMILUMINESCENT REAGENT SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2016-08-11 US disclosed
US-9347947-B2 Immunoassays employing non-particulate chemiluminescent reagent SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2016-05-24 US disclosed
US-9023998-B2 Near infrared fluorogen and fluorescent activating proteins for in vivo imaging and live-cell biosensing CARNEGIE MELLON UNIVERSITY (US) 2015-05-05 US disclosed
US-9023998-B2 Near infrared fluorogen and fluorescent activating proteins for in vivo imaging and live-cell biosensing CARNEGIE MELLON UNIVERSITY (US) 2015-05-05 US disclosed
US-9023998-B2 Near infrared fluorogen and fluorescent activating proteins for in vivo imaging and live-cell biosensing CARNEGIE MELLON UNIVERSITY (US) 2015-05-05 US disclosed
US-20140243509-A1 NEAR INFRARED FLUOROGEN AND FLUORESCENT ACTIVATING PROTEINS FOR IN VIVO IMAGING AND LIVE-CELL BIOSENSING CARNEGIE MELLON UNIVERSITY 2014-08-28 US disclosed
US-20140243509-A1 NEAR INFRARED FLUOROGEN AND FLUORESCENT ACTIVATING PROTEINS FOR IN VIVO IMAGING AND LIVE-CELL BIOSENSING CARNEGIE MELLON UNIVERSITY 2014-08-28 US disclosed
US-20140243509-A1 NEAR INFRARED FLUOROGEN AND FLUORESCENT ACTIVATING PROTEINS FOR IN VIVO IMAGING AND LIVE-CELL BIOSENSING CARNEGIE MELLON UNIVERSITY 2014-08-28 US disclosed
US-20100233725-A1 IMMUNOASSAYS EMPLOYING NON-PARTICULATE CHEMILUMINESCENT REAGENT SIEMENS HEALTHCARE DIAGNOSTICS INC., A CORPORATION OF CALIFORNIA (US) 2010-09-16 US disclosed
US-7635571-B2 photosenstizer generates singlet oxygen which oxidatively cleaves the linker to form a product which can be detected in a sandwich detection assay; kits SIEMENS HEALTHCARE DIAGNOSTICS PRODUCTS GMBH (DE) 2009-12-22 US disclosed
US-7635571-B2 photosenstizer generates singlet oxygen which oxidatively cleaves the linker to form a product which can be detected in a sandwich detection assay; kits SIEMENS HEALTHCARE DIAGNOSTICS PRODUCTS GMBH (DE) 2009-12-22 US disclosed
US-7229842-B2 Metal chelate containing compositions for use in chemiluminescent assays DADE BEHRING MARBURG GMBH (DE) 2007-06-12 US disclosed
US-7229842-B2 Metal chelate containing compositions for use in chemiluminescent assays DADE BEHRING MARBURG GMBH (DE) 2007-06-12 US disclosed
US-6406667-B1 FLUORESCENT COMPOUNDS FOR CHEMILUMINESCENT COMPOUNDS DADE BEHRING MARBURG GMBH (DE) 2002-06-18 US disclosed
EP-1078265-A1 CHEMILUMINESCENT COMPOSITIONS FOR USE IN DETECTION OF MULTIPLE ANALYTES DADE BEHRING INC. (US) 2001-02-28 EP disclosed
WO-1999042838-A1 CHEMILUMINESCENT COMPOSITIONS FOR USE IN DETECTION OF MULTIPLE ANALYTES DADE BEHRING INC. (US) 1999-08-26 WO disclosed
US-5532171-A PHENOTHIAZINE DYES FOR PHOTODYNAMIC THERAPY OF CANCER OR IMMUNOASSAY TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-07-02 US disclosed
US-5344928-A Phenothiazine compounds for cancer treatment or immunoassay using chemiluminescence TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-09-06 US disclosed
EP-0510668-A2 Phenothiazine derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-10-28 EP 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-20140243509-A1 NEAR INFRARED FLUOROGEN AND FLUORESCENT ACTIVATING PROTEINS FOR IN VIVO IMAGING AND LIVE-CELL BIOSENSING FUCA1, TYR, HBG2 SMN1; SMN2 3629/4885ALOX5 2666/4885CYP4F2 14/4885

“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.