SCHEMBL1603402

SCHEMBL1603402

O=C(O)c1c2ccccc2nc2cccc(Cl)c12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 7/20 0.58
KMT2A Q03164 4/20 0.56
PDE10A Q9Y233 5/20 0.50
CLK1 P49759 1/20 0.50
CDK9 P50750 1/20 0.50
CDK5 Q00535 1/20 0.50
DYRK1A Q13627 1/20 0.50
DYRK2 Q92630 1/20 0.50
CLK4 Q9HAZ1 1/20 0.50
DYRK1B Q9Y463 1/20 0.50
LMNA P02545 1/20 0.47
TSHR P16473 1/20 0.46
MEN1 O00255 3/20 0.46
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
CYP2C19 P33261 2/20 0.43
CYP2D6 P10635 1/20 0.43
GUSB P08236 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42

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
Hydrochloric Acid SCHEMBL9597546 0.98 DHODH (0.57) DHODHKMT2APDE10ACLK1CDK9
SCHEMBL14917525 0.81 DHODH (0.53) DHODHKMT2APDE10ALMNATSHR
SCHEMBL7590081 0.80 PDE10A (0.58) DHODHKMT2APDE10ALMNATSHR
SCHEMBL27802771 0.80 PDE10A (0.50) DHODHKMT2APDE10ALMNATSHR
SCHEMBL29377848 0.80 PDE10A (0.66) DHODHKMT2APDE10ACLK4LMNA
SCHEMBL641899 0.80 PDE10A (0.66) DHODHKMT2APDE10ACLK4LMNA
SCHEMBL10476973 0.79 DHODH (0.54) DHODHKMT2APDE10ALMNATSHR
Hydrochloric Acid SCHEMBL9842693 0.79 PDE10A (0.57) DHODHKMT2APDE10ALMNATSHR
SCHEMBL7534026 0.78 PDE10A (0.51) DHODHKMT2APDE10ALMNATSHR
Iodide SCHEMBL8029601 0.78 PDE10A (0.63) DHODHKMT2APDE10ACLK4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110082279-A1 Chemiluminescent Compounds GEN-PROBE INCORPORATED (US) 2011-04-07 US disclosed
EP-1658503-B1 CHEMILUMINESCENT COMPOUNDS MOLECULAR LIGHT TECH RES LTD (GB) 2009-11-18 EP disclosed
US-20070166759-A1 Chemiluminescent compounds GEN-PROBE CARDIFF, LTD. (GB) 2007-07-19 US disclosed
EP-1029016-B1 NOVEL CHEMILUMINESCENT LABELING COMPOUNDS LUMIGEN INC (US) 2007-03-07 EP disclosed
EP-1658503-A1 CHEMILUMINESCENT COMPOUNDS Molecular Light Technology Research Limited (GB) 2006-05-24 EP disclosed
EP-1005649-B1 NON-ENZYMATIC METHODS OF GENERATING CHEMILUMINESCENCE FROM ACRIDAN ALKENES LUMIGEN INC (US) 2006-04-12 EP disclosed
WO-2005022161-A1 CHEMILUMINESCENT COMPOUNDS MOLECULAR LIGHT TECHNOLOGY RESEARCH LIMITED (GB) 2005-03-10 WO disclosed
EP-1029016-A4 NOVEL CHEMILUMINESCENT LABELING COMPOUNDS LUMIGEN INC (US) 2003-06-25 EP disclosed
EP-1005649-A4 NON-ENZYMATIC METHODS OF GENERATING CHEMILUMINESCENCE FROM ACRIDAN ALKENES LUMIGEN INC (US) 2003-06-18 EP disclosed
EP-0625510-B1 Novel N-alkylacridan carboxyl derivatives useful for chemiluminescent detection LUMIGEN INC (US) 2003-04-02 EP disclosed
EP-0778946-A4 NOVEL METHOD AND KITS FOR PRODUCING LIGHT FROM AN ACRIDAN COMPOUND LUMIGEN INC (US) 1999-01-27 EP disclosed
EP-0844246-A1 REAGENTS FOR LABELING SH GROUPS, PROCESS FOR THE PREPARATION OF THEM, AND METHOD FOR LABELING WITH THEM SS Pharmaceutical Co., Ltd. (JP) 1998-05-27 EP disclosed
US-5723295-A MULTISTAGE CHEMILUMINESCENT ASSAY WITH PEROXIDASE ENZYME, PH ADJUSTMENT LUMIGEN, INC. (US) 1998-03-03 US disclosed
CN-1161083-A Novel method and kits for producing light from 9,10-azetine compound LUMIGEN INC (US) 1997-10-01 CN disclosed
US-5670644-A CHEMILUMINESCENT REACTIONS, PEROXIDASE AND PH FOR IMMUNOASSAY LUMIGEN, INC. (US) 1997-09-23 US disclosed
EP-0778946-A1 NOVEL METHOD AND KITS FOR PRODUCING LIGHT FROM AN ACRIDAN COMPOUND LUMIGEN, INC. (US) 1997-06-18 EP disclosed
WO-1996007912-A1 NOVEL METHOD AND KITS FOR PRODUCING LIGHT FROM AN ACRIDAN COMPOUND LUMIGEN, INC. (US) 1996-03-14 WO disclosed
US-5491072-A N-alkylacridan carboxyl derivatives useful for chemiluminescent detection LUMIGEN, INC. (US) 1996-02-13 US disclosed
WO-1994026927-A1 NOVEL N-ALKYLACRIDAN CARBOXYL DERIVATIVES USEFUL FOR CHEMILUMINESCENT DETECTION LUMIGEN, INC. (US) 1994-11-24 WO disclosed
EP-0625510-A2 Novel N-alkylacridan carboxyl derivatives useful for chemiluminescent detection LUMIGEN, INC. (US) 1994-11-23 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 (2 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-20070166759-A1 Chemiluminescent compounds CBR3, CBR1, LTC4S DHODH 2354/4885KMT2A 3854/4885PDE10A 183/4885
US-20110082279-A1 Chemiluminescent Compounds CBR3, LTC4S, CBR1 DHODH 2434/4885KMT2A 3896/4885PDE10A 202/4885

“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.