SCHEMBL10044901

SCHEMBL10044901

CCOC(=O)c1c(O)c2c(CC)cccc2n(C)c1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.67
KDM4E B2RXH2 4/20 0.67
MEN1 O00255 1/20 0.59
POLB P06746 1/20 0.59
PABPC1 P11940 1/20 0.59
KMT2A Q03164 1/20 0.59
LMNA P02545 2/20 0.54
HTT P42858 1/20 0.52
NPC1 O15118 1/20 0.51
ALOX15 P16050 1/20 0.51
RECQL P46063 1/20 0.50
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.46
TSHR P16473 1/20 0.44
L3MBTL1 Q9Y468 1/20 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
SCHEMBL7617278 0.91 ALDH1A1 (0.62) ALDH1A1KDM4EMEN1POLBPABPC1
SCHEMBL10044897 0.88 KDM4E (0.51) ALDH1A1KDM4EMEN1POLBPABPC1
SCHEMBL7598991 0.88 ALDH1A1 (0.68) ALDH1A1KDM4EMEN1POLBPABPC1
SCHEMBL1685962 0.86 ALDH1A1 (0.65) ALDH1A1KDM4EMEN1POLBPABPC1
SCHEMBL7597398 0.86 ALDH1A1 (0.65) ALDH1A1KDM4EMEN1POLBPABPC1
SCHEMBL6996658 0.85 ALDH1A1 (0.64) ALDH1A1KDM4EMEN1POLBPABPC1
SCHEMBL7614893 0.84 ALDH1A1 (0.62) ALDH1A1KDM4EMEN1POLBPABPC1
SCHEMBL5165226 0.84 ALDH1A1 (0.62) ALDH1A1KDM4EMEN1POLBPABPC1
SCHEMBL17713228 0.84 ALDH1A1 (0.45) ALDH1A1KDM4EMEN1POLBPABPC1
SCHEMBL29463790 0.84 ALDH1A1 (0.45) ALDH1A1KDM4EMEN1POLBPABPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170333577-A1 QUINOLINE-3-CARBOXAMIDE COMPOUNDS AND THEIR USE IN DIAGNOSIS Westfälische Wilhelms-Universität Münster (DE) 2017-11-23 US disclosed
EP-2590949-B1 METHOD FOR MANUFACTURING OF QUINOLINE-3-CARBOXAMIDES ACTIVE BIOTECH AB (SE) 2015-11-25 EP disclosed
EP-2590949-B1 METHOD FOR MANUFACTURING OF QUINOLINE-3-CARBOXAMIDES ACTIVE BIOTECH AB (SE) 2015-11-25 EP disclosed
US-8871936-B2 Method for manufacturing of quinoline-3-carboxamides ACTIVE BIOTECH AB (SE) 2014-10-28 US disclosed
US-8871936-B2 Method for manufacturing of quinoline-3-carboxamides ACTIVE BIOTECH AB (SE) 2014-10-28 US disclosed
US-8871936-B2 Method for manufacturing of quinoline-3-carboxamides ACTIVE BIOTECH AB (SE) 2014-10-28 US disclosed
US-20130109860-A1 METHOD FOR MANUFACTURING OF QUINOLINE-3-CARBOXAMIDES ACTIVE BIOTECH AB (SE) 2013-05-02 US disclosed
US-20130109860-A1 METHOD FOR MANUFACTURING OF QUINOLINE-3-CARBOXAMIDES ACTIVE BIOTECH AB (SE) 2013-05-02 US disclosed
US-20130109860-A1 METHOD FOR MANUFACTURING OF QUINOLINE-3-CARBOXAMIDES ACTIVE BIOTECH AB (SE) 2013-05-02 US disclosed
WO-2012004338-A1 METHOD FOR MANUFACTURING OF QUINOLINE-3-CARBOXAMIDES ACTIVE BIOTECH AB (SE) 2012-01-12 WO 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-20170333577-A1 QUINOLINE-3-CARBOXAMIDE COMPOUNDS AND THEIR USE IN DIAGNOSIS S100A9, S100A4, S100A10 ALDH1A1 3371/4885KDM4E 3186/4885MEN1 3766/4885
US-20130109860-A1 METHOD FOR MANUFACTURING OF QUINOLINE-3-CARBOXAMIDES ADH1A, ADH5, ADH1C ALDH1A1 7/4885KDM4E 1451/4885MEN1 2723/4885

“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.