SCHEMBL5740800

SCHEMBL5740800

O=C1C2CCCCN2C(=O)N1c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.66
ALDH1A1 P00352 5/20 0.55
TDP1 Q9NUW8 1/20 0.55
MEN1 O00255 2/20 0.54
AR P10275 2/20 0.51
RAB9A P51151 1/20 0.46
GAA P10253 1/20 0.46
GFER P55789 1/20 0.46
MT-CO2 P00403 2/20 0.44
ALOX5 P09917 2/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL5740339 0.95 KMT2A (0.72) KMT2AALDH1A1TDP1MEN1AR
SCHEMBL15919496 0.84 AR (0.52) KMT2AALDH1A1MEN1ARRAB9A
SCHEMBL11041126 0.84 AR (0.55) KMT2AALDH1A1MEN1AR
SCHEMBL5740340 0.84 KMT2A (0.91) KMT2AALDH1A1TDP1MEN1GAA
SCHEMBL13879549 0.84 AR (0.55) KMT2AALDH1A1MEN1AR
SCHEMBL11167757 0.83 ALDH1A1 (0.62) KMT2AALDH1A1MEN1ARALOX5
SCHEMBL15904944 0.81 AR (0.49) KMT2AALDH1A1TDP1MEN1AR
SCHEMBL13879514 0.81 ALDH1A1 (0.60) KMT2AALDH1A1ARGAAMAPT
SCHEMBL13879494 0.81 KMT2A (0.72) KMT2AALDH1A1MEN1ARGAA
SCHEMBL13879492 0.79 AR (0.53) KMT2AALDH1A1MEN1AR

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 7 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
EP-1244670-B1 HYDANTOIN DERIVATIVE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USING SAME MGI GP INC (US) 2006-03-08 EP disclosed
US-6974823-B2 Hydantoin derivative compounds, pharmaceutical compositions, and methods of using same GPI NIL HOLDINDGS, INC. (US) 2005-12-13 US disclosed
US-20030203890-A1 Method for treating nerve injury caused as a result of surgery NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2003-10-30 US disclosed
US-20020058685-A1 Hydantoin derivative compounds, pharmace utical compositions, and methods of using same GLIAMED, INC. 2002-05-16 US 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 (3 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-20030203890-A1 Method for treating nerve injury caused as a result of surgery NGF, BDNF, GAP43 KMT2A 4086/4885ALDH1A1 824/4885TDP1 178/4885
US-20090099186-A1 INHIBITORS OF VIRAL REPLICATION EIF2AK2, HAVCR2, RTF2 KMT2A 2463/4885ALDH1A1 1500/4885TDP1 3859/4885
US-20020058685-A1 Hydantoin derivative compounds, pharmace utical compositions, and methods of using same HNMT, HAAO, HTR3E KMT2A 3409/4885ALDH1A1 1066/4885TDP1 1456/4885

“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.