SCHEMBL1615058

SCHEMBL1615058

COC(=O)c1ncc(C#N)nc1Nc1ccc([Si](C)(C)C)cc1F

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 1/20 0.34
▸ BACE1 P56817 1/20 0.34
▸ BACE2 Q9Y5Z0 1/20 0.34
▸ MAPK14 Q16539 2/20 0.34
▸ THRB P10828 1/20 0.34
▸ DHODH Q02127 1/20 0.33
▸ MAP2K1 Q02750 1/20 0.33
▸ CHEK1 O14757 8/20 0.33
▸ MAPK13 O15264 1/20 0.33
▸ HPGD P15428 1/20 0.32
▸ GPR119 Q8TDV5 2/20 0.32
▸ EGFR P00533 1/20 0.32
▸ ERBB2 P04626 1/20 0.32
▸ SRC P12931 1/20 0.32
▸ CHEK2 O96017 1/20 0.32
▸ ALK Q9UM73 1/20 0.31

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
SCHEMBL1615984 0.86 EGFR (0.36) MAPK14THRBDHODHMAP2K1MAPK13
SCHEMBL31135605 0.83 MAP2K1 (0.38) MAPK14DHODHMAP2K1HPGD
SCHEMBL1615794 0.83 MAP2K1 (0.38) MAPK14DHODHMAP2K1HPGD
SCHEMBL1615631 0.81 THRB (0.36) MAPK14THRBDHODHMAP2K1MAPK13
SCHEMBL1615831 0.79 THRB (0.35) MAPK14THRBDHODHMAPK13ALK
SCHEMBL1615057 0.77 MAP2K1 (0.36) DHODHMAP2K1HPGD
SCHEMBL31135636 0.77 MAP2K1 (0.36) DHODHMAP2K1HPGD
SCHEMBL1615191 0.75 AURKA (0.36) MAPK14THRBDHODHMAP2K1EGFR
SCHEMBL1568135 0.72 MAP2K1 (0.43) MAP2K1HPGD
SCHEMBL1615894 0.70 KEAP1 (0.37) MAPK14THRBDHODHMAP2K1EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9206174-B2 5-anilinoimidazopyridines and methods of use GENENTECH, INC. (US) 2015-12-08 — — US disclosed
US-9206174-B2 5-anilinoimidazopyridines and methods of use GENENTECH, INC. (US) 2015-12-08 — — US disclosed
EP-2690101-B1 5-Anilinoimidazopyridines and Methods of Use GENENTECH INC (US) 2015-06-24 — — EP disclosed
EP-2690101-B1 5-Anilinoimidazopyridines and Methods of Use GENENTECH INC (US) 2015-06-24 — — EP disclosed
EP-2690101-A1 5-Anilinoimidazopyridines and Methods of Use Genentech, Inc. (US) 2014-01-29 — — EP disclosed
EP-2690101-A1 5-Anilinoimidazopyridines and Methods of Use Genentech, Inc. (US) 2014-01-29 — — EP disclosed
EP-2222675-B1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE GENENTECH INC (US) 2013-09-11 — — EP disclosed
EP-2222675-B1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE GENENTECH INC (US) 2013-09-11 — — EP disclosed
US-20130150584-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE GENENTECH, INC. (US) 2013-06-13 — — US disclosed
US-20130150584-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE GENENTECH, INC. (US) 2013-06-13 — — US disclosed
US-20120309765-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE GENENTECH, INC. (US) 2012-12-06 — — US disclosed
US-8288408-B2 5-anilinoimidazopyridines and methods of use GENENTECH, INC. (US) 2012-10-16 — — US disclosed
US-20110158990-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE GENENTECH, INC. (US) 2011-06-30 — — US disclosed
US-7923456-B2 5-anilinoimidazo[1,5-a]-pyridines inhibitors of MEK kinase GENENTECH, INC. (US) 2011-04-12 — — US disclosed
US-7923456-B2 5-anilinoimidazo[1,5-a]-pyridines inhibitors of MEK kinase GENENTECH, INC. (US) 2011-04-12 — — US disclosed
EP-2222675-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE Genentech, Inc. (US) 2010-09-01 — — EP disclosed
US-20100004269-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE GENENTECH, INC. (US) 2010-01-07 — — US disclosed
US-20100004269-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE GENENTECH, INC. (US) 2010-01-07 — — US disclosed
WO-2009085983-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE GENENTECH, INC. (US) 2009-07-09 — — 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 (4 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-20120309765-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE MKI67, PCNA, TYMP APP 4767/4885BACE1 4781/4885BACE2 4578/4885
US-20110158990-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE MKI67, PCNA, TYMP APP 4767/4885BACE1 4781/4885BACE2 4578/4885
US-20100004269-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE MKI67, MAP3K5, MAPKAPK5 APP 4336/4885BACE1 4309/4885BACE2 4269/4885
US-20130150584-A1 5-ANILINOIMIDAZOPYRIDINES AND METHODS OF USE MKI67, PCNA, TYMP APP 4767/4885BACE1 4781/4885BACE2 4578/4885

“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.

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