SCHEMBL2352247

SCHEMBL2352247

NC(=O)c1ccc(F)c(C(=O)c2c[nH]c3ncc(Cl)cc23)c1F

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 9/20 0.63
RIPK2 O43353 2/20 0.63
RAF1 P04049 2/20 0.63
KDR P35968 2/20 0.63
MAP2K2 P36507 2/20 0.63
TGFBR2 P37173 2/20 0.63
NEK2 P51955 2/20 0.63
MAP2K1 Q02750 2/20 0.63
TNK2 Q07912 2/20 0.63
MAP2K5 Q13163 2/20 0.63
PTK6 Q13882 2/20 0.63
NEK11 Q8NG66 2/20 0.63
MAP3K20 Q9NYL2 2/20 0.63
MAP4K5 Q9Y4K4 2/20 0.63
BMPR1B O00238 1/20 0.63
PLK4 O00444 1/20 0.63
PIR O00625 1/20 0.63
AURKA O14965 1/20 0.63
DCLK1 O15075 1/20 0.63
EPHB6 O15197 1/20 0.63

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
SCHEMBL3507259 0.92 BRAF (0.55) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL3505935 0.90 CYP2C19 (0.52) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL3703307 0.89 BRAF (0.51) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL13505689 0.89 BRAF (0.53) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL432500 0.88 BRAF (0.66) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL2354890 0.88 BRAF (0.64) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL2889134 0.88 BRAF (0.63) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL30078249 0.87 BRAF (0.62) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL298199 0.87 BRAF (0.62) BRAFRIPK2RAF1KDRMAP2K2
SCHEMBL2886604 0.87 CYP2C19 (0.67) BRAFRIPK2RAF1KDRMAP2K2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8470818-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2013-06-25 US claimed
US-20120245174-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2012-09-27 US claimed
EP-1893612-B1 PYRROLO [2, 3-B]PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON INC (US) 2011-08-03 EP claimed
US-7863289-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON, INC. (US) 2011-01-04 US claimed
US-20100286142-A1 Compounds and Methods for Kinase Modulation, and Indications Therefor PLEXXIKON, INC. 2010-11-11 US claimed
US-20100249118-A1 protein kinase modulators such as Propane-1-sulfonic acid [2,4-difluoro-3-(5-ethoxy-1H-pyrrolo[1,3-b]pyridine-3-carbonyl)-phenyl]-amide, used to regulate signal transduction cascades, involved in the control of physiological functions including cellular growth and proliferation; anticarcinogenic agents PLEXXIKON INC. 2010-09-30 US claimed
EP-2097414-A1 PYRROLO [2, 3-B]PYRIDINE DERIVATIVES AS KINASE MODULATORS PLEXXIKON, INC. (US) 2009-09-09 EP claimed
US-20080167338-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC 2008-07-10 US claimed
WO-2008079903-A1 PYRROLO [2, 3-B] PYRIDINE DERIVATIVES AS KINASE MODULATORS PLEXXIKON, INC. (US) 2008-07-03 WO claimed
WO-2008079906-A1 PYRROLO [2, 3-B] PYRIDINE DERIVATIVES AS KINASE MODULATORS PLEXXIKON, INC. (US) 2008-07-03 WO claimed
EP-2958571-B1 DNA HYPOMETHYLATING AGENTS FOR CANCER THERAPY MAIO MICHELE (IT) 2024-04-10 EP disclosed
US-20230277534-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2023-09-07 US disclosed
US-11337976-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2022-05-24 US disclosed
US-20210338701-A1 DNA HYPOMETHYLATING AGENTS FOR CANCER THERAPY MAIO MICHELE (IT) 2021-11-04 US disclosed
US-11083743-B2 DNA hypomethylating agents for cancer therapy MAIO MICHELE (IT) 2021-08-10 US disclosed
WO-2008079903-A1 PYRROLO [2, 3-B] PYRIDINE DERIVATIVES AS KINASE MODULATORS PLEXXIKON, INC. (US) 2008-07-03 WO disclosed
WO-2008079906-A1 PYRROLO [2, 3-B] PYRIDINE DERIVATIVES AS KINASE MODULATORS PLEXXIKON, INC. (US) 2008-07-03 WO disclosed
EP-1893612-A1 PYRROLO [2, 3-B]PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2008-03-05 EP disclosed
WO-2007002325-A1 PYRROLO[2,3-B] PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2007-01-04 WO disclosed
WO-2007002433-A1 PYRROLO [2, 3-B] PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2007-01-04 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 (6 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-20100249118-A1 protein kinase modulators such as Propane-1-sulfonic acid [2,4-difluoro-3-(5-ethoxy-1H-pyrrolo[1,3-b]pyridine-3-carbonyl)-phenyl]-amide, used to regulate signal transduction cascades, involved in the control of physiological functions including cellular growth and proliferation; anticarcinogenic agents MAP4K1, MAP4K2, MAP3K1 BRAF 95/4885RIPK2 477/4885RAF1 36/4885
US-20080167338-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 BRAF 48/4885RIPK2 514/4885RAF1 78/4885
US-11337976-B2 Compounds and methods for kinase modulation, and indications therefor MAP3K20, PRKACA, MAP3K13 BRAF 49/4885RIPK2 504/4885RAF1 74/4885
US-20230277534-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, PRKACA, MAP3K13 BRAF 49/4885RIPK2 504/4885RAF1 74/4885
US-20100286142-A1 Compounds and Methods for Kinase Modulation, and Indications Therefor BRAF, ARAF, RAF1 BRAF 1/4885RIPK2 1064/4885RAF1 3/4885
US-20120245174-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR BRAF, ARAF, RAF1 BRAF 1/4885RIPK2 1064/4885RAF1 3/4885

“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.