SCHEMBL15645113

SCHEMBL15645113

Cc1cc2c(C(N)=NO)ccnc2[nH]1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 7/20 0.39
▸ CHUK O15111 7/20 0.39
▸ CCNK O75909 1/20 0.39
▸ CDK12 Q9NYV4 1/20 0.39
▸ ROCK1 Q13464 1/20 0.38
▸ CIT O14578 5/20 0.37
▸ AURKB Q96GD4 1/20 0.37
▸ AURKAIP1 Q9NWT8 1/20 0.37
▸ PIK3C3 Q8NEB9 2/20 0.36
▸ MAP3K5 Q99683 1/20 0.36
▸ AAK1 Q2M2I8 1/20 0.35
▸ HIPK4 Q8NE63 1/20 0.35
▸ MKNK2 Q9HBH9 1/20 0.35
▸ BMP2K Q9NSY1 1/20 0.35
▸ TRPA1 O75762 1/20 0.35
▸ KIT P10721 1/20 0.34
▸ BTK Q06187 1/20 0.34

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
SCHEMBL16908237 0.81 CCNK (0.44) IKBKBCHUKCCNKCDK12ROCK1
SCHEMBL15646520 0.78 IKBKB (0.42) IKBKBCHUKCIT
SCHEMBL16897078 0.78 CIT (0.40) IKBKBCHUKCITKIT
Acetic Acid SCHEMBL15646249 0.75 CIT (0.40) IKBKBCHUKCCNKCDK12ROCK1
SCHEMBL15645111 0.75 IKBKB (0.41) IKBKBCHUKCCNKCDK12ROCK1
SCHEMBL15646740 0.73 PBK (0.52) BTK
SCHEMBL12618980 0.73 NUDT1 (0.49) IKBKBCHUKROCK1CITAURKB
SCHEMBL12653267 0.73 NUDT1 (0.49) IKBKBCHUKROCK1CITAURKB
SCHEMBL2144858 0.73 CCNK (0.38) CCNKCDK12
SCHEMBL16897066 0.72 XDH (0.40) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3129372-B1 AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C CANCER RESEARCH TECH LTD (GB) 2020-12-16 — — EP disclosed
EP-2900666-B1 AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C CANCER RESEARCH TECH LTD (GB) 2020-11-04 — — EP disclosed
US-10414763-B2 Azaquinazoline inhibitors of atypical protein kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2019-09-17 — — US disclosed
US-9914730-B2 Azaquinazoline inhibitors of Atypical protein Kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-03-13 — — US disclosed
US-9896446-B2 Azaquinazoline inhibitors of atypical protein kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2018-02-20 — — US disclosed
EP-3129372-A1 AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C Cancer Research Technology Limited (GB) 2017-02-15 — — EP disclosed
US-20160102094-A1 Azaquinazoline Inhibitors of Atypical Protein Kinase C IGNYTA, INC. (US) 2016-04-14 — — US disclosed
CN-105102456-A Azaquinazoline inhibitors of atypical protein kinase C IGNYTA INC 2015-11-25 — — CN disclosed
US-20150274720-A1 Azaquinazoline Inhibitors Of Atypical Protein Kinase C WINDTREE THERAPEUTICS, INC. 2015-10-01 — — US disclosed
WO-2015148597-A1 AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C IGNYTA, INC. (US) 2015-10-01 — — WO disclosed
EP-2900666-A1 AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C Ignyta, Inc. (US) 2015-08-05 — — EP disclosed
WO-2014052699-A9 AZAQUINAZOLINE INHIBITORS OF ATYPICAL PROTEIN KINASE C IGNYTA, INC. (US) 2015-07-16 — — WO disclosed
US-20140113882-A1 Azaquinazoline Inhibitors of Atypical Protein Kinase C CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2014-04-24 — — 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 (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-20160102094-A1 Azaquinazoline Inhibitors of Atypical Protein Kinase C PRKCQ, PRKCZ, PRKCE IKBKB 636/4885CHUK 266/4885CCNK 283/4885
US-20140113882-A1 Azaquinazoline Inhibitors of Atypical Protein Kinase C PRKCQ, PRKCZ, PRKCE IKBKB 624/4885CHUK 259/4885CCNK 258/4885
US-10414763-B2 Azaquinazoline inhibitors of atypical protein kinase C PRKCQ, PRKCA, PRKCZ IKBKB 441/4885CHUK 152/4885CCNK 282/4885
US-20150274720-A1 Azaquinazoline Inhibitors Of Atypical Protein Kinase C PRKCQ, PRKCA, PRKCZ IKBKB 441/4885CHUK 152/4885CCNK 282/4885

“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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