SCHEMBL13879409

SCHEMBL13879409

COc1ccc(N2C(=O)NC(C)(Cc3ccccc3)C2=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ITGAL P20701 1/20 0.49
ELANE P08246 3/20 0.48
MAPT P10636 4/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
TSHR P16473 1/20 0.46
PGR P06401 1/20 0.46
NR1H3 Q13133 1/20 0.46
HSD11B1 P28845 2/20 0.44
ALDH1A1 P00352 2/20 0.43
RAB9A P51151 2/20 0.42
KDM4E B2RXH2 1/20 0.42
NPC1 O15118 1/20 0.42
GAA P10253 1/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RGS4 P49798 1/20 0.42
RGS8 P57771 1/20 0.42
MGLL Q99685 1/20 0.42

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
SCHEMBL11569756 0.87 ELANE (0.61) ITGALELANEPGRALDH1A1
SCHEMBL13879421 0.87 ITGAL (0.50) ITGALELANEMAPTMEN1KMT2A
SCHEMBL13879502 0.84 ITGAL (0.61) ITGALELANEMAPTPGRALDH1A1
SCHEMBL13879591 0.79 MGLL (0.47) ITGALELANEMAPTMEN1KMT2A
SCHEMBL6167893 0.79 ELANE (0.45) ITGALELANEMEN1KMT2ATSHR
SCHEMBL13879533 0.78 ITGAL (0.76) ITGALELANETSHR
SCHEMBL13879551 0.76 ITGAL (0.62) ITGALELANEMAPTMEN1KMT2A
SCHEMBL8723051 0.75 MAPT (0.56) ELANEMAPTMEN1KMT2APGR
SCHEMBL13879517 0.73 ITGAL (0.51) ITGALELANEMAPTMEN1KMT2A
SCHEMBL13879378 0.72 ITGAL (0.44) ITGALELANEALDH1A1KDM4E

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 4495/4885ELANE 364/4885MAPT 4203/4885

“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.