SCHEMBL1502186

SCHEMBL1502186

Nc1c(Nc2cccc(-c3c[nH]cn3)c2)c(=O)c1=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPKAPK2 P49137 3/20 0.34
ABL1 P00519 3/20 0.33
EGFR P00533 2/20 0.33
BRAF P15056 2/20 0.33
BCR P11274 2/20 0.33
SRC P12931 1/20 0.33
PRKACA P17612 1/20 0.33
PRKACG P22612 1/20 0.33
PRKACB P22694 1/20 0.33
CAMK2D Q13557 1/20 0.32
BUB1 O43683 2/20 0.32
XDH P47989 1/20 0.32
CDK1 P06493 1/20 0.31
PRKCA P17252 1/20 0.31
PLK1 P53350 1/20 0.31
CCNT1 O60563 1/20 0.31
CDK9 P50750 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
SCHEMBL7916081 0.79 CNR1 (0.47) MAPKAPK2ABL1BCRPRKCAPLK1
SCHEMBL7913085 0.77 VCP (0.46) MEN1POLBKMT2AMAPKAPK2PLK1
SCHEMBL7905830 0.76 SIRT2 (0.48) MEN1POLBKMT2APLK1GSK3B
SCHEMBL6799593 0.74 CA12 (0.42) ABL1EGFRBRAFBCRSRC
SCHEMBL7913081 0.74 HDAC3 (0.46) MEN1POLBKMT2AMAPKAPK2ABL1
SCHEMBL12852522 0.73 NTRK1 (0.45) MEN1KMT2AEGFRPLK1CDK9
SCHEMBL7915476 0.73 CNR1 (0.45) MEN1POLBKMT2AABL1EGFR
SCHEMBL7905484 0.72 MEN1 (0.50) MEN1KMT2AABL1EGFRBCR
SCHEMBL7905810 0.72 HPGDS (0.38) MEN1POLBKMT2AMAPKAPK2ABL1
SCHEMBL8230052 0.71 ADORA2A (0.53) MEN1POLBKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110136796-A1 IDO Inhibitors NEWLINK GENETICS (US) 2011-06-09 US 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-6211220-B1 ANTITUMOR AGENTS AND ANTICARCIINOGENIC AGENTS CELL PATHWAYS, INC. 2001-04-03 US 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
US-20110136796-A1 IDO Inhibitors NEWLINK GENETICS (US) 2011-06-09 US 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
US-6211220-B1 ANTITUMOR AGENTS AND ANTICARCIINOGENIC AGENTS CELL PATHWAYS, INC. 2001-04-03 US disclosed
WO-1994029277-A1 AMILINO- OR PYRIDYLAMINO- CYCLOBUTENE- 1,2-DIONE DERIVATIVES AS cGMP PHOSPHODIESTERASE INHIBITORS SMITHKLINE BEECHAM PLC (GB) 1994-12-22 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 (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 MEN1 2262/4885POLB 2996/4885KMT2A 520/4885
US-20110136796-A1 IDO Inhibitors IDO1, IDO2, INMT MEN1 2262/4885POLB 2996/4885KMT2A 520/4885

“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.