SCHEMBL4878057

SCHEMBL4878057

Cc1nc2c(s1)C(=O)OC2=O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 8/20 0.37
PTGS2 P35354 7/20 0.35
PTGS1 P23219 4/20 0.35
KMT5A Q9NQR1 2/20 0.34
MEN1 O00255 1/20 0.34
THRB P10828 1/20 0.34
CCND1 P24385 1/20 0.34
BLM P54132 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ALOX5 P09917 1/20 0.33
CDC25A P30304 1/20 0.33
CDC25B P30305 1/20 0.33
CDC25C P30307 1/20 0.33
NTRK1 P04629 1/20 0.32

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
SCHEMBL13470064 0.72 CDK4 (0.45) CDK4PTGS2PTGS1KMT5AMEN1
SCHEMBL13470368 0.72 CDK4 (0.45) CDK4PTGS2PTGS1KMT5AMEN1
SCHEMBL31060254 0.65 CDK4 (0.44) CDK4PTGS2PTGS1KMT5AMEN1
SCHEMBL7816362 0.64 IDO1 (0.55) CDK4PTGS2PTGS1KMT5AMEN1
SCHEMBL16885422 0.63 CDK4 (0.46) CDK4PTGS2PTGS1MEN1THRB
SCHEMBL15436988 0.62 ALOX5 (0.33) CDK4PTGS2PTGS1KMT5AMEN1
SCHEMBL16284914 0.61 ALOX5 (0.36) CDK4PTGS2PTGS1KMT5AMEN1
SCHEMBL14217298 0.57 TSHR (0.41) TDP1
SCHEMBL13434368 0.56 TSHR (0.33)
SCHEMBL12335757 0.56 ALOX5 (0.61) CDK4ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080214533-A1 Cyclic Iminocarbamates And Their Use BAYER HEALTHCARE AG (DE) 2008-09-04 US disclosed
US-20080214533-A1 Cyclic Iminocarbamates And Their Use BAYER HEALTHCARE AG (DE) 2008-09-04 US disclosed
US-20080214533-A1 Cyclic Iminocarbamates And Their Use BAYER HEALTHCARE AG (DE) 2008-09-04 US disclosed
EP-1819701-A1 CYCLIC IMINOCARBAMATES AND USE THEREOF Bayer HealthCare AG (DE) 2007-08-22 EP disclosed
WO-2006058630-A1 CYCLIC IMINOCARBAMATES AND USE THEREOF BAYER HEALTHCARE AG (DE) 2006-06-08 WO disclosed
WO-2006058630-A1 CYCLIC IMINOCARBAMATES AND USE THEREOF BAYER HEALTHCARE AG (DE) 2006-06-08 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-20080214533-A1 Cyclic Iminocarbamates And Their Use F2, UQCRB, F12 CDK4 736/4885PTGS2 821/4885PTGS1 514/4885

“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.