SCHEMBL7520668

SCHEMBL7520668

O=C(NCc1cccc(Cl)c1)NC1=CC(=O)OC1

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ROCK2 O75116 2/20 0.48
EPHX2 P34913 1/20 0.48
ROCK1 Q13464 1/20 0.47
GAA P10253 1/20 0.46
MTOR P42345 1/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.45
ATG4B Q9Y4P1 1/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
NAMPT P43490 1/20 0.43

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
SCHEMBL7519969 0.84 GSK3B (0.50) MEN1KMT2AROCK2ROCK1NPC1
SCHEMBL7522024 0.80 KMT2A (0.62) MEN1KMT2AEPHX2NPC1RAB9A
SCHEMBL7516319 0.77 RAB9A (0.52) MEN1KMT2AROCK2ROCK1GAA
SCHEMBL28566662 0.73 RAB9A (0.66) MEN1KMT2AROCK2MTORNPC1
SCHEMBL30050253 0.73 RAB9A (0.66) MEN1KMT2AROCK2MTORNPC1
SCHEMBL6190779 0.72 TUBB4A (0.51) MEN1KMT2AGAANPC1RAB9A
SCHEMBL13647316 0.71 GAA (0.54) EPHX2GAAMTORNPC1RAB9A
SCHEMBL7516899 0.71 NPC1 (0.51) MEN1KMT2AEPHX2NPC1RAB9A
Lozilurea SCHEMBL1812194 0.70 GAA (0.56) MEN1KMT2AEPHX2GAAMTOR
SCHEMBL7519777 0.69 MEN1 (0.54) MEN1KMT2A

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-20020058694-A1 Ureido and thioureido derivatives of 4-amino-2(5H)-furanones and 4-amino-2(5H)-thiophenones as antitumor agents ROCHE DIAGNOSTICS GMBH 2002-05-16 US disclosed
US-6333346-B1 AMINOFURANONEUREAS OR THIOUREAS 4-AMINO-2(5H)-THIOPHENONES AS ANTITUMOR AGENTS ROCHE DIAGNOSTICS GMBH (DE) 2001-12-25 US disclosed
EP-1009747-A1 UREIDO AND THIOUREIDO DERIVATIVES OF 4-AMINO-2(5H)-FURANONES AND 4-AMINO-2(5H)-THIOPHENONES AS ANTITUMOR AGENTS Roche Diagnostics GmbH (DE) 2000-06-21 EP disclosed
WO-1999012917-A1 UREIDO AND THIOUREIDO DERIVATIVES OF 4-AMINO-2(5H)-FURANONES AND 4-AMINO-2(5H)-THIOPHENONES AS ANTITUMOR AGENTS ROCHE DIAGNOSTICS GMBH (DE) 1999-03-18 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-20020058694-A1 Ureido and thioureido derivatives of 4-amino-2(5H)-furanones and 4-amino-2(5H)-thiophenones as antitumor agents UTS2R, SRD5A2, SRD5A1 MEN1 3390/4885KMT2A 3288/4885ROCK2 4741/4885

“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.