SCHEMBL5496801

SCHEMBL5496801

O=C(O)CN(C(=O)OCC1c2ccccc2-c2ccccc21)c1cccc(Cl)c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PTGIR P43119 6/20 0.46
PTGDR Q13258 2/20 0.46
FABP5 Q01469 3/20 0.43
FABP7 O15540 2/20 0.43
KMT2A Q03164 2/20 0.43
EPHX2 P34913 1/20 0.41
PTGER1 P34995 1/20 0.36
PTGER4 P35408 1/20 0.36
PTGER3 P43115 1/20 0.36
PTGER2 P43116 1/20 0.36
BCL2A1 Q16548 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
CASP3 P42574 1/20 0.36
ACLY P53396 2/20 0.36

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 0.88 KMT2A (0.47) PTGIRPTGDRFABP5FABP7KMT2A
SCHEMBL3822341 0.87 EPHX2 (0.53) PTGIRPTGDRFABP5FABP7KMT2A
SCHEMBL3820525 0.87 FABP5 (0.46) PTGIRPTGDRFABP5FABP7KMT2A
SCHEMBL3814521 0.86 EPHX2 (0.41) PTGIRPTGDRFABP5FABP7KMT2A
SCHEMBL3822541 0.86 PTGIR (0.46) PTGIRPTGDRFABP5FABP7KMT2A
SCHEMBL3811371 0.86 PTGIR (0.46) PTGIRFABP5FABP7KMT2AEPHX2
SCHEMBL27696329 0.84 KMT2A (0.42) FABP5FABP7KMT2AEPHX2CASP3
SCHEMBL3812268 0.84 PTGIR (0.48) PTGIRPTGDRFABP5FABP7KMT2A
SCHEMBL3822175 0.84 KMT2A (0.43) PTGIRFABP5FABP7KMT2AEPHX2
SCHEMBL3816301 0.83 KMT2A (0.41) FABP5FABP7KMT2AEPHX2CASP3

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
EP-1754705-A2 Antagonists for treatment of CD11/CD18 adhesion receptor mediated disorders Genentech, Inc. (US) 2007-02-21 EP disclosed
EP-1063982-B1 ANTAGONISTS FOR TREATMENT OF CD11/CD18 ADHESION RECEPTOR MEDIATED DISORDERS GENENTECH INC (US) 2007-02-14 EP disclosed
US-20050203135-A1 Antagonists for treatment of CD/11CD18 adhesion receptor mediated disorders GENENTECH, INC. 2005-09-15 US disclosed
CN-1191063-C Antagonists for treatment of CD11/CD18 adhesion receptor mediated disorders GENENTECH INC (US) 2005-03-02 CN disclosed
CN-1295471-A Antagonists for treatment of CD11/CD18 adhesion receptor mediated disorders GENENTECH INC (US) 2001-05-16 CN disclosed
EP-1063982-A2 ANTAGONISTS FOR TREATMENT OF CD11/CD18 ADHESION RECEPTOR MEDIATED DISORDERS Genentech, Inc. (US) 2001-01-03 EP disclosed
WO-1999049856-A2 ANTAGONISTS FOR TREATMENT OF CD11/CD18 ADHESION RECEPTOR MEDIATED DISORDERS GENENTECH, INC. (US) 1999-10-07 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-20050203135-A1 Antagonists for treatment of CD/11CD18 adhesion receptor mediated disorders VCAM1, CD58, ITGB8 PTGIR 343/4885PTGDR 105/4885FABP5 1671/4885

“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.