SCHEMBL13879532

SCHEMBL13879532

COc1cccc(N2C(=O)C3CCCN3C2=O)c1

nearest known ligand 0.77

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.77
GAA P10253 2/20 0.54
GFER P55789 1/20 0.54
AR P10275 1/20 0.53
ALDH1A1 P00352 5/20 0.51
USP2 O75604 1/20 0.49
MAPT P10636 3/20 0.49
MGLL Q99685 1/20 0.49
MEN1 O00255 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TSHR P16473 1/20 0.48
CASP1 P29466 1/20 0.48
CASP7 P55210 1/20 0.48
HSD17B10 Q99714 1/20 0.48

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
SCHEMBL13879494 0.96 KMT2A (0.72) KMT2AGAAGFERARALDH1A1
SCHEMBL13879554 0.85 TSHR (0.61) KMT2AARALDH1A1MAPTTSHR
SCHEMBL13879579 0.82 AR (0.60) KMT2AARALDH1A1MEN1TSHR
SCHEMBL13879514 0.81 ALDH1A1 (0.60) KMT2AGAAARALDH1A1MAPT
SCHEMBL5740339 0.80 KMT2A (0.72) KMT2AGAAGFERARALDH1A1
SCHEMBL13879404 0.79 TSHR (0.78) KMT2AGAAGFERALDH1A1USP2
SCHEMBL13879549 0.78 AR (0.55) KMT2AARALDH1A1MEN1TSHR
SCHEMBL11167757 0.77 ALDH1A1 (0.62) KMT2AARALDH1A1MGLLMEN1
SCHEMBL10465001 0.77 ALDH1A1 (0.55) KMT2AGAAGFERARALDH1A1
SCHEMBL5740800 0.76 KMT2A (0.66) KMT2AGAAGFERARALDH1A1

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 KMT2A 2463/4885GAA 463/4885GFER 4050/4885

“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.