SCHEMBL497480

SCHEMBL497480

Nc1cc(-c2ccccc2)c2cc(Cl)ccc2n1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 4/20 0.61
AURKA O14965 1/20 0.56
AURKB Q96GD4 1/20 0.56
ELANE P08246 1/20 0.55
MAPT P10636 3/20 0.50
GAA P10253 1/20 0.50
HTT P42858 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 3/20 0.47
ALDH1A1 P00352 3/20 0.47
LMNA P02545 2/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 4/20 0.47
MAT2A P31153 1/20 0.47
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
BACE1 P56817 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
POLB P06746 1/20 0.46

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
SCHEMBL497514 0.89 MAPK1 (0.49) MAPK1AURKAAURKBELANEMAPT
SCHEMBL11826284 0.83 MAPK1 (0.65) MAPK1AURKAAURKBELANEMAPT
SCHEMBL8956330 0.83 MAPK1 (0.85) MAPK1AURKAAURKBELANEMAPT
SCHEMBL8410911 0.81 MAPK1 (0.82) MAPK1AURKAAURKBELANEMAPT
SCHEMBL2319415 0.80 BACE1 (0.58) RAB9ASMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL28883104 0.80 MAPK1 (0.61) MAPK1AURKAAURKBELANEMAPT
SCHEMBL29074153 0.80 MAPK1 (0.61) MAPK1AURKAAURKBELANEMAPT
SCHEMBL11822896 0.80 ALDH1A1 (0.61) MAPK1AURKAAURKBELANEMAPT
SCHEMBL29074154 0.79 MAPK1 (0.60) MAPK1AURKAAURKBELANEMAPT
SCHEMBL28460515 0.76 MAPK1 (0.57) MAPK1AURKAAURKBELANEMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116554211-A Blue fluorescent material based on fluoroborobiquinoline complex, and preparation method and application thereof 东南大学 2023-08-08 CN disclosed
EP-1999112-B1 SUBSTITUTED 2-AMINO-4-PHENYL-DIHYDROQUINOLINES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS MEDICAMENTS, AND MEDICAMENTS CONTAINING THEM SANOFI SA (FR) 2015-04-22 EP disclosed
US-8399674-B2 Quinolines HOFFMAN-LA ROCHE INC. (US) 2013-03-19 US disclosed
US-8399674-B2 Quinolines HOFFMAN-LA ROCHE INC. (US) 2013-03-19 US disclosed
US-8399674-B2 Quinolines HOFFMAN-LA ROCHE INC. (US) 2013-03-19 US disclosed
US-20120136018-A1 QUINOLINES KOLCZEWSKI SABINE (DE) 2012-05-31 US disclosed
US-20120136018-A1 QUINOLINES KOLCZEWSKI SABINE (DE) 2012-05-31 US disclosed
US-20120136018-A1 QUINOLINES KOLCZEWSKI SABINE (DE) 2012-05-31 US disclosed
US-8106204-B2 Substituted 2-amino-4-phenyldihydroquinolines, processes for their preparation, pharmaceutical compositions and methods for their use SANOFI-AVENTIS (FR) 2012-01-31 US disclosed
EP-2195296-A1 QUINOLINE DERIVATIVES AS 5HT5A RECEPTOR ANTAGONISTS F. Hoffmann-Roche AG (CH) 2010-06-16 EP disclosed
US-20090088451-A1 QUINOLINES F. HOFFMANN-LA ROCHE AG (CH) 2009-04-02 US disclosed
US-20090088451-A1 QUINOLINES F. HOFFMANN-LA ROCHE AG (CH) 2009-04-02 US disclosed
US-20090088451-A1 QUINOLINES F. HOFFMANN-LA ROCHE AG (CH) 2009-04-02 US disclosed
CN-101395137-A Substituted 2-amino-4-phenyl-dhydroquinolines, method for the production thereof, use thereof as medicaments, and medicaments containing them SANOFI AVENTIS (FR) 2009-03-25 CN disclosed
US-20090048258-A1 Amide Compound TAKEDA, PHARMACEUTICAL COMPANY LIMITED (JP) 2009-02-19 US disclosed
EP-1999112-A2 SUBSTITUTED 2-AMINO-4-PHENYL-D HYDROQUINOLINES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS MEDICAMENTS, AND MEDICAMENTS CONTAINING THEM Sanofi-Aventis (FR) 2008-12-10 EP disclosed
EP-1845081-A1 AMIDE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2007-10-17 EP disclosed
WO-2007107246-A2 SUBSTITUTED 2-AMINO-4-PHENYL-DιHYDROQUINOLINES, METHOD FOR THE PRODUCTION THEREOF, USE THEREOF AS MEDICAMENTS, AND MEDICAMENTS CONTAINING THEM SANOFI-AVENTIS (DE) 2007-09-27 WO disclosed
CN-1028754-C process for preparing quinoline derivatives TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1995-06-07 CN disclosed
CN-1039416-A Quinoline and preparation thereof and purposes TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1990-02-07 CN 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 (3 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-20090088451-A1 QUINOLINES HTR5A, HTR1A, HTR1E MAPK1 2462/4885AURKA 2522/4885AURKB 2443/4885
US-20120136018-A1 QUINOLINES HTR5A, HTR1A, HTR1E MAPK1 2462/4885AURKA 2522/4885AURKB 2443/4885
US-20090048258-A1 Amide Compound DLAT, DGAT1, DGAT2 MAPK1 2607/4885AURKA 4708/4885AURKB 4475/4885

“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.