SCHEMBL1502132

SCHEMBL1502132

CCNc1cc(-c2c[nH]cn2)ccn1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKD1 Q15139 1/20 0.44
PRKD2 Q9BZL6 1/20 0.44
MAPK14 Q16539 4/20 0.41
MAPK13 O15264 3/20 0.41
MAPK12 P53778 3/20 0.41
MAPK11 Q15759 3/20 0.41
MAPT P10636 1/20 0.39
KARS1 Q15046 3/20 0.36
HRH4 Q9H3N8 4/20 0.35
ROCK2 O75116 2/20 0.35
ROCK1 Q13464 2/20 0.35
EEF2K O00418 1/20 0.35
PLK1 P53350 1/20 0.35
MAPK10 P53779 1/20 0.35
PDPK1 O15530 1/20 0.34
LRRK2 Q5S007 1/20 0.34
CDC42BPB Q9Y5S2 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
SCHEMBL11102704 0.88 HRH4 (0.41) PRKD1PRKD2MAPK14KARS1HRH4
SCHEMBL11100755 0.84 MAPK14 (0.47) PRKD1PRKD2MAPK14MAPK13MAPK12
SCHEMBL11102425 0.83 ROCK1 (0.44) PRKD1MAPTKARS1ROCK2ROCK1
SCHEMBL11100753 0.81 MAPK14 (0.40) PRKD1PRKD2MAPK14MAPK10
SCHEMBL11098688 0.81 PRKD1 (0.48) PRKD1PRKD2MAPK14MAPK13MAPK12
SCHEMBL11101994 0.80 MAPK10 (0.32) PRKD1PRKD2KARS1PLK1MAPK10
SCHEMBL11101947 0.80 NOS2 (0.54) PRKD2MAPK14MAPK13MAPK12MAPK11
SCHEMBL25095006 0.80 MAPK10 (0.33) MAPK14MAPTROCK2ROCK1MAPK10
SCHEMBL11099057 0.79 PRKD1 (0.45) PRKD1PRKD2MAPK14MAPK13MAPK12
SCHEMBL11103308 0.79 PRKD1 (0.45) PRKD1PRKD2MAPK14MAPK13MAPK12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110136796-A1 IDO Inhibitors NEWLINK GENETICS (US) 2011-06-09 US claimed
CN-102083429-A Ido inhibitors NEWLINK GENETICS 2011-06-01 CN claimed
EP-2291187-A2 IDO INHIBITORS Newlink Genetics (US) 2011-03-09 EP claimed
WO-2009132238-A2 IDO INHIBITORS NEWLINK GENETICS (US) 2009-10-29 WO claimed
US-9174942-B2 IDO inhibitors NEWLINK GENETICS CORPORATION (US) 2015-11-03 US disclosed
US-20140323740-A1 IDO Inhibitors NEWLINK GENETICS CORPORATION (US) 2014-10-30 US disclosed
US-8748469-B2 IDO inhibitors NEWLINK GENETICS CORPORATION (US) 2014-06-10 US disclosed
CN-102083429-B Ido inhibitors NEWLINK GENETICS 2014-05-28 CN disclosed
US-20110136796-A1 IDO Inhibitors NEWLINK GENETICS (US) 2011-06-09 US disclosed
CN-102083429-A Ido inhibitors NEWLINK GENETICS 2011-06-01 CN disclosed
EP-2291187-A2 IDO INHIBITORS Newlink Genetics (US) 2011-03-09 EP disclosed
WO-2009132238-A2 IDO INHIBITORS NEWLINK GENETICS (US) 2009-10-29 WO disclosed
EP-0051371-B1 IMIDAZOLYLPYRIDINE THERAPEUTIC AGENTS PFIZER INC. (US) 1984-08-29 EP disclosed
EP-0051371-A2 Imidazolylpyridine therapeutic agents PFIZER INC. (US) 1982-05-12 EP disclosed
US-4302464-A ANTIULCER AGENTS, ANTI-H2-HISTAMINES PFIZER INC. (US) 1981-11-24 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 (2 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-20140323740-A1 IDO Inhibitors IDO1, IDO2, INMT PRKD1 3921/4885PRKD2 3250/4885MAPK14 3740/4885
US-20110136796-A1 IDO Inhibitors IDO1, IDO2, INMT PRKD1 3921/4885PRKD2 3250/4885MAPK14 3740/4885

“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.