SCHEMBL4048663

SCHEMBL4048663

N#Cc1cccc(N(O)C(=N)c2nonc2N)c1F

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 18/20 0.36
PKM P14618 1/20 0.33
MAPT P10636 1/20 0.33
RPS6KB1 P23443 1/20 0.32
ROCK1 Q13464 1/20 0.32
LMNA P02545 1/20 0.32
TDO2 P48775 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
SCHEMBL6046559 0.82 IDO1 (0.40) IDO1PKMMAPTTDO2
SCHEMBL16322251 0.79 PKM (0.42) IDO1PKMMAPTTDO2
SCHEMBL16321293 0.77 IDO1 (0.37) IDO1PKMTDO2
SCHEMBL12230830 0.76 IDO1 (0.39) IDO1PKMMAPTLMNATDO2
SCHEMBL4048995 0.76 KMT2A (0.41) IDO1MAPT
SCHEMBL6046615 0.74 GAA (0.42) IDO1PKMMAPTLMNATDO2
SCHEMBL19812520 0.74 KMT2A (0.39) IDO1MAPTLMNA
SCHEMBL4052452 0.71 PKM (0.43) IDO1PKMMAPTLMNATDO2
SCHEMBL2517465 0.70 IDO1 (0.59) IDO1MAPTLMNATDO2
SCHEMBL16340917 0.69 IDO1 (0.35) IDO1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140377292-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2014-12-25 US claimed
EP-1879573-A4 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME INCYTE CORP (US) 2009-07-08 EP claimed
EP-1879573-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME Incyte Corporation (US) 2008-01-23 EP claimed
WO-2006122150-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME INCYTE CORPORATION (US) 2006-11-16 WO claimed

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-20140377292-A1 MODULATORS OF INDOLEAMINE 2,3-DIOXYGENASE AND METHODS OF USING THE SAME IDO1, IDO2, INMT IDO1 1/4885PKM 1661/4885MAPT 3106/4885

“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.