SCHEMBL13879421

SCHEMBL13879421

COc1cccc(N2C(=O)NC(C)(Cc3ccccc3)C2=O)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ITGAL P20701 1/20 0.50
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 3/20 0.47
MGLL Q99685 1/20 0.47
ELANE P08246 2/20 0.46
MCHR1 Q99705 1/20 0.45
NR1H3 Q13133 2/20 0.44
NR1H2 P55055 1/20 0.43
CMA1 P23946 1/20 0.42
PSMB5 P28074 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP1A2 P05177 1/20 0.41
NR3C2 P08235 1/20 0.41
MAOB P27338 1/20 0.40

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
SCHEMBL13879409 0.87 ITGAL (0.49) ITGALMEN1KMT2AMAPTMGLL
SCHEMBL11569756 0.85 ELANE (0.61) ITGALELANEALDH1A1CYP1A2
SCHEMBL13879551 0.85 ITGAL (0.62) ITGALMEN1KMT2AMAPTMGLL
SCHEMBL13879533 0.79 ITGAL (0.76) ITGALELANE
SCHEMBL13879591 0.77 MGLL (0.47) ITGALMEN1KMT2AMAPTMGLL
SCHEMBL13879502 0.76 ITGAL (0.61) ITGALMAPTELANEALDH1A1
SCHEMBL6167893 0.72 ELANE (0.45) ITGALMEN1KMT2AMGLLELANE
SCHEMBL13879517 0.71 ITGAL (0.51) ITGALMEN1KMT2AMAPTMGLL
SCHEMBL1192049 0.70 AR (0.58) MEN1KMT2AMGLLALDH1A1CYP1A2
SCHEMBL13879378 0.70 ITGAL (0.44) ITGALELANEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 US disclosed
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. 2009-04-16 US disclosed
WO-2007047146-A2 INHIBITORS OF VIRAL REPLICATION INTERMUNE, INC. (US) 2007-04-26 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 (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-20090099186-A1 INHIBITORS OF VIRAL REPLICATION EIF2AK2, HAVCR2, RTF2 ITGAL 4495/4885MEN1 4395/4885KMT2A 2463/4885

“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.