SCHEMBL377683

SCHEMBL377683

Cc1c(C(=O)Nc2ccc(Oc3ccnc4cc(O)ccc34)c(F)c2)c(=O)n(-c2ccccc2)n1C

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.83
KDR P35968 17/20 0.83
IGF1R P08069 13/20 0.83
INSR P06213 2/20 0.80
AURKA O14965 1/20 0.80
JAK2 O60674 1/20 0.80
RPS6KA5 O75582 1/20 0.80
ABL1 P00519 1/20 0.80
LCK P06239 1/20 0.80
RET P07949 1/20 0.80
KIT P10721 1/20 0.80
PIM1 P11309 1/20 0.80
FGFR1 P11362 1/20 0.80
SRC P12931 1/20 0.80
PRKACA P17612 1/20 0.80
RPS6KB1 P23443 1/20 0.80
JAK1 P23458 1/20 0.80
MAPK3 P27361 1/20 0.80
AKT1 P31749 1/20 0.80
AKT2 P31751 1/20 0.80

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
SCHEMBL199381 0.91 MET (1.00) METKDRIGF1RINSRAURKA
SCHEMBL2158221 0.89 MET (0.90) METKDRIGF1RINSRAURKA
SCHEMBL12004043 0.88 MET (0.84) METKDRIGF1RINSRAURKA
SCHEMBL199084 0.88 MET (0.85) METKDRIGF1RINSRAURKA
Ningetinib SCHEMBL29392305 0.88 MET (1.00) METKDRIGF1RINSRAURKA
Ningetinib SCHEMBL12003786 0.88 MET (1.00) METKDRIGF1RINSRAURKA
Ningetinib SCHEMBL29366570 0.88 MET (1.00) METKDRIGF1RINSRAURKA
SCHEMBL12003909 0.87 MET (1.00) METKDRIGF1RINSRAURKA
SCHEMBL12003908 0.87 MET (1.00) METKDRIGF1RINSRAURKA
Ningetinib SCHEMBL12003712 0.87 MET (0.99) METKDRIGF1RINSRAURKA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2532657-B9 Compounds and methods of use SUNSHINE LAKE PHARMA CO LTD (CN) 2017-04-19 EP disclosed
US-9598400-B2 Substituted quinoline compounds and methods of use CALITOR SCIENCES, LLC (US) 2017-03-21 US disclosed
EP-2532657-B1 Compounds and methods of use SUNSHINE LAKE PHARMA CO LTD (CN) 2016-08-31 EP disclosed
EP-2680886-B1 SUBSTITUTED QUINOLINE COMPOUNDS CALITOR SCIENCES LLC (US) 2016-08-10 EP disclosed
EP-2408300-B1 AMINO ESTER DERIVATIVES, SALTS THEREOF AND METHODS OF USE SUNSHINE LAKE PHARMA CO LTD (CN) 2016-05-11 EP disclosed
US-20150342945-A1 SUBSTITUTED QUINOLINE COMPOUNDS AND METHODS OF USE CALITOR SCIENCES, LLC (US) 2015-12-03 US disclosed
US-9133162-B2 Substituted quinoline compounds and methods of use SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-09-15 US disclosed
EP-2680886-A1 SUBSTITUTED QUINOLINE COMPOUNDS AND METHODS OF USE Calitor Sciences, LLC (US) 2014-01-08 EP disclosed
US-8426585-B2 Compounds comprising a spiro-ring Xi, Ning (US) 2013-04-23 US disclosed
US-20120315247-A1 COMPOUNDS COMPRISING A SPIRO-RING AND METHODS OF USE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2012-12-13 US disclosed
US-8293897-B2 Compounds comprising a spiro-ring and methods of use Xi, Ning (US) 2012-10-23 US disclosed
WO-2012118632-A1 SUBSTITUTED QUINOLINE COMPOUNDS AND METHODS OF USE XI NING (US) 2012-09-07 WO disclosed
US-20120219522-A1 SUBSTITUTED QUINOLINE COMPOUNDS AND METHODS OF USE XI, Dr. Ning (US) 2012-08-30 US disclosed
US-8232294-B2 Amino ester derivatives, sailts thereof and methods of use Xi, Ning (US) 2012-07-31 US disclosed
EP-2408300-A1 AMINO ESTER DERIVATIVES, SALTS THEREOF AND METHODS OF USE Sunshine Lake Pharma Co., Ltd (CN) 2012-01-25 EP disclosed
EP-2340244-A1 COMPOUNDS AND METHODS OF USE Xi, Ning (US) 2011-07-06 EP disclosed
WO-2010111063-A1 AMINO ESTER DERIVATIVES, SALTS THEREOF AND METHODS OF USE XI NING (US) 2010-09-30 WO disclosed
US-20100239576-A1 AMINO ESTER DERIVATIVES, SAILTS THEREOF AND METHODS OF USE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2010-09-23 US disclosed
WO-2010045095-A1 COMPOUNDS AND METHODS OF USE XI NING (US) 2010-04-22 WO disclosed
US-20100093727-A1 COMPOUNDS AND METHODS OF USE SUNSHINE LAKE PHARMA CO., LTD. (CN) 2010-04-15 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 (5 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-20150342945-A1 SUBSTITUTED QUINOLINE COMPOUNDS AND METHODS OF USE MKI67, MCL1, NRAS MET 997/4885KDR 577/4885IGF1R 1984/4885
US-20100239576-A1 AMINO ESTER DERIVATIVES, SAILTS THEREOF AND METHODS OF USE SRC, BCAT1, BCAT2 MET 185/4885KDR 958/4885IGF1R 599/4885
US-20100093727-A1 COMPOUNDS AND METHODS OF USE PRKDC, PRKACA, PRKX MET 302/4885KDR 600/4885IGF1R 493/4885
US-20120315247-A1 COMPOUNDS COMPRISING A SPIRO-RING AND METHODS OF USE CDC42BPG, HRAS, PTPRJ MET 732/4885KDR 728/4885IGF1R 614/4885
US-20120219522-A1 SUBSTITUTED QUINOLINE COMPOUNDS AND METHODS OF USE MKI67, MCL1, NRAS MET 997/4885KDR 577/4885IGF1R 1984/4885

“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.