SCHEMBL1971011

SCHEMBL1971011

COC(=O)c1ccn2cncc2c1Nc1ccc(Br)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
KCNH2 Q12809 1/20 0.43
LCK P06239 5/20 0.41
SMC2 O95347 1/20 0.41
EGFR P00533 1/20 0.41
CSNK2A2 P19784 1/20 0.41
MAP2K2 P36507 1/20 0.41
MAP2K1 Q02750 1/20 0.41
SMC1A Q14683 1/20 0.41
AAK1 Q2M2I8 1/20 0.41
Q6ZSR9 Q6ZSR9 1/20 0.41
BMP2K Q9NSY1 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 4/20 0.38
MEN1 O00255 3/20 0.38
CTDSP1 Q9GZU7 1/20 0.38
SRC P12931 1/20 0.38
GAA P10253 2/20 0.37
MAPT P10636 2/20 0.37

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
SCHEMBL1969541 0.88 CYP2C9 (0.43) CYP2C9CYP2C19KCNH2LCKSMC2
SCHEMBL1970513 0.88 CYP2C9 (0.54) CYP2C9CYP2C19KCNH2MAP2K2MAP2K1
SCHEMBL1971814 0.82 CYP2C9 (0.67) CYP2C9CYP2C19KCNH2SMC2EGFR
SCHEMBL1970730 0.78 CYP2C9 (0.53) CYP2C9CYP2C19KCNH2SMC2EGFR
SCHEMBL3729451 0.76 CYP2C9 (0.52) CYP2C9CYP2C19KCNH2LCKMAP2K2
SCHEMBL3458736 0.75 CYP2C9 (0.54) CYP2C9CYP2C19KCNH2MAP2K2MAP2K1
SCHEMBL1969212 0.74 LCK (0.44) CYP2C9CYP2C19KCNH2LCKGAA
SCHEMBL1971873 0.74 CYP2C9 (0.51) CYP2C9CYP2C19KCNH2LCKMAP2K1
SCHEMBL1341369 0.73 MAP2K1 (0.53) SMC2EGFRCSNK2A2MAP2K2MAP2K1
SCHEMBL3975135 0.73 MAP2K1 (0.45) SMC2EGFRCSNK2A2MAP2K2MAP2K1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8293763-B2 8-anilinoimidazopyridines and their use as anti-cancer and/or anti-inflammatory agents GENENTECH, INC. (US) 2012-10-23 US disclosed
US-8293763-B2 8-anilinoimidazopyridines and their use as anti-cancer and/or anti-inflammatory agents GENENTECH, INC. (US) 2012-10-23 US disclosed
US-8293763-B2 8-anilinoimidazopyridines and their use as anti-cancer and/or anti-inflammatory agents GENENTECH, INC. (US) 2012-10-23 US disclosed
EP-2231662-B1 8-ANILINOIMIDAZOPYRIDINES AND THEIR USE AS ANTI-CANCER AND/OR ANTI-INFLAMMATORY AGENTS GENENTECH INC (US) 2011-06-22 EP disclosed
EP-2231662-B1 8-ANILINOIMIDAZOPYRIDINES AND THEIR USE AS ANTI-CANCER AND/OR ANTI-INFLAMMATORY AGENTS GENENTECH INC (US) 2011-06-22 EP disclosed
US-20100280063-A1 8-ANILINOIMIDAZOPYRIDINES AND THEIR USE AS ANTI-CANCER AND/OR ANTI-INFLAMMATORY AGENTS GENENTECH, INC. 2010-11-04 US disclosed
US-20100280063-A1 8-ANILINOIMIDAZOPYRIDINES AND THEIR USE AS ANTI-CANCER AND/OR ANTI-INFLAMMATORY AGENTS GENENTECH, INC. 2010-11-04 US disclosed
US-20100280063-A1 8-ANILINOIMIDAZOPYRIDINES AND THEIR USE AS ANTI-CANCER AND/OR ANTI-INFLAMMATORY AGENTS GENENTECH, INC. 2010-11-04 US disclosed
EP-2231662-A1 8-ANILIN0IMIDAZ0PYRIDINES AND THEIR USE AS ANTI-CANCER AND/OR ANTI-INFLAMMATORY AGENTS Genentech, Inc. (US) 2010-09-29 EP disclosed
WO-2009085980-A1 8-ANILIN0IMIDAZ0PYRIDINES AND THEIR USE AS ANTI-CANCER AND/OR ANTI-INFLAMMATORY AGENTS GENENTECH, INC. (US) 2009-07-09 WO disclosed
WO-2009085980-A1 8-ANILIN0IMIDAZ0PYRIDINES AND THEIR USE AS ANTI-CANCER AND/OR ANTI-INFLAMMATORY AGENTS 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 (1 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-20100280063-A1 8-ANILINOIMIDAZOPYRIDINES AND THEIR USE AS ANTI-CANCER AND/OR ANTI-INFLAMMATORY AGENTS MAP3K8, MAPK8, MAP3K1 CYP2C9 1838/4885CYP2C19 2035/4885KCNH2 1456/4885

“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.