SCHEMBL3812973

SCHEMBL3812973

Cc1ccc(N(CC(=O)O)C(=O)OCC2c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 1/20 0.43
PTGDR Q13258 1/20 0.43
KMT2A Q03164 2/20 0.43
FABP5 Q01469 3/20 0.43
FABP7 O15540 2/20 0.43
CASP3 P42574 2/20 0.40
EPHX2 P34913 1/20 0.39
MDM2 Q00987 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL900046 0.91 KMT2A (0.47) PTGIRPTGDRKMT2AFABP5FABP7
SCHEMBL1622971 0.89 KMT2A (0.44) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL3818461 0.89 EPHX2 (0.44) PTGIRKMT2AFABP5FABP7CASP3
SCHEMBL3659499 0.88 PTGIR (0.45) PTGIRPTGDRKMT2AFABP5FABP7
SCHEMBL5847171 0.88 KMT2A (0.43) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL3820525 0.88 FABP5 (0.46) PTGIRPTGDRKMT2AFABP5FABP7
SCHEMBL3817315 0.88 PTGIR (0.43) PTGIRPTGDRKMT2AFABP5FABP7
SCHEMBL3814178 0.87 FABP5 (0.41) KMT2AFABP5FABP7CASP3EPHX2
SCHEMBL3811371 0.87 PTGIR (0.46) PTGIRKMT2AFABP5FABP7CASP3
SCHEMBL27696345 0.86 KMT2A (0.44) KMT2AFABP5FABP7CASP3EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1791837-B1 SUBSTITUTED HYDANTOINS FOR THE TREATMENT OF CANCER HOFFMANN LA ROCHE (CH) 2009-08-19 EP disclosed
US-7371869-B2 Substituted hydantoins HOFFMANN-LA ROCHE INC. (US) 2008-05-13 US disclosed
EP-1791837-A1 SUBSTITUTED HYDANTOINS FOR THE TREATMENT OF CANCER F. Hoffmann-Roche AG (CH) 2007-06-06 EP disclosed
WO-2006029862-A1 SUBSTITUTED HYDANTOINS FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2006-03-23 WO disclosed
US-20060063814-A1 Substituted hydantoins GOODNOW ROBERT A JR 2006-03-23 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 (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-20060063814-A1 Substituted hydantoins HNMT, MAPK6, KYNU PTGIR 1610/4885PTGDR 622/4885KMT2A 118/4885

“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.