SCHEMBL1136378

SCHEMBL1136378

Cc1ccc(NC(=O)c2ccccc2)cc1C(=O)Nc1cnc2[nH]c(-c3ccccc3)nc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.53
MMP9 P14780 4/20 0.53
MMP8 P22894 4/20 0.53
MMP13 P45452 4/20 0.53
BTK Q06187 4/20 0.52
BLK P51451 2/20 0.52
KDM4E B2RXH2 2/20 0.52
MAPT P10636 2/20 0.52
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
HPGD P15428 1/20 0.52
HTT P42858 1/20 0.52
NR2E3 Q9Y5X4 2/20 0.51
COMT P21964 1/20 0.50
LCK P06239 3/20 0.49
KDR P35968 3/20 0.49
MAPK14 Q16539 2/20 0.49
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
KMT2A Q03164 2/20 0.48

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
SCHEMBL1136409 0.96 BLK (0.57) MMP2MMP9MMP8MMP13BTK
SCHEMBL1136398 0.94 BTK (0.59) MMP2MMP9MMP8MMP13BTK
SCHEMBL4487422 0.88 MMP2 (0.58) MMP2MMP9MMP8MMP13KDM4E
SCHEMBL1136397 0.88 NR2E3 (0.61) MMP2MMP9MMP8MMP13KDM4E
SCHEMBL1136389 0.87 DGAT1 (0.54) BTKBLKKDM4EMAPTHPGD
SCHEMBL1136423 0.87 CHEK2 (0.52) MMP2MMP9MMP8MMP13BTK
SCHEMBL1136406 0.87 BLK (0.48) MMP2MMP9MMP8MMP13BTK
SCHEMBL1136433 0.86 BTK (0.57) MMP2MMP9MMP13BTKBLK
SCHEMBL1136434 0.86 BTK (0.57) MMP2MMP9MMP13BTKBLK
SCHEMBL5306882 0.86 MMP2 (0.66) MMP2MMP9MMP8MMP13MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1919910-B1 AZABENZIMIDAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS ANTI-CANCER AGENTS HOFFMANN LA ROCHE (CH) 2011-02-23 EP claimed
CN-101208338-B Azabenzimidazole derivatives, their manufacture and use as anti-cancer agents HOFFMANN LA ROCHE 2010-12-29 CN claimed
US-20090227578-A1 Azabenzimidazole Derivatives, Their Manufacture and Use as Anti-Cancer Agents F. HOFFMANN-LA ROCHE AG (CH) 2009-09-10 US claimed
CN-101208338-A Azabenzimidazole derivatives, their manufacture and use as anti-cancer agents HOFFMANN LA ROCHE (CH) 2008-06-25 CN claimed
EP-1919910-A1 AZABENZIMIDAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS ANTI-CANCER AGENTS F. Hoffmann-la Roche AG (CH) 2008-05-14 EP claimed
WO-2007017143-A1 AZABENZIMIDAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS ANTI-CANCER AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2007-02-15 WO claimed
EP-1919910-B1 AZABENZIMIDAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS ANTI-CANCER AGENTS HOFFMANN LA ROCHE (CH) 2011-02-23 EP disclosed
CN-101208338-B Azabenzimidazole derivatives, their manufacture and use as anti-cancer agents HOFFMANN LA ROCHE 2010-12-29 CN disclosed
US-20090227578-A1 Azabenzimidazole Derivatives, Their Manufacture and Use as Anti-Cancer Agents F. HOFFMANN-LA ROCHE AG (CH) 2009-09-10 US disclosed
CN-101208338-A Azabenzimidazole derivatives, their manufacture and use as anti-cancer agents HOFFMANN LA ROCHE (CH) 2008-06-25 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 (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-20090227578-A1 Azabenzimidazole Derivatives, Their Manufacture and Use as Anti-Cancer Agents AZI2, CDKN1A, CCNI MMP2 1903/4885MMP9 1480/4885MMP8 2143/4885

“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.