SCHEMBL3928964

SCHEMBL3928964

O=C(NC1(C(=O)O)CCC1)c1cc(Cl)c2ccccc2c1OCCOc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 5/20 0.62
CXCR5 P32302 1/20 0.40
ERAP1 Q9NZ08 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
FABP4 P15090 2/20 0.39
FABP5 Q01469 1/20 0.39
GPR132 Q9UNW8 1/20 0.38
DRD2 P14416 1/20 0.38
DRD3 P35462 1/20 0.38
LPAR1 Q92633 1/20 0.37
TRPV1 Q8NER1 1/20 0.37
PYGL P06737 3/20 0.37
SCN9A Q15858 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL4518345 0.95 CXCR2 (0.62) CXCR2CXCR5ERAP1FABP4FABP5
SCHEMBL3933368 0.93 CXCR2 (0.73) CXCR2CXCR5ERAP1FABP4FABP5
SCHEMBL3924926 0.89 CXCR2 (0.54) CXCR2CXCR5ERAP1FABP4FABP5
SCHEMBL3926345 0.88 CXCR2 (0.51) CXCR2CXCR5ERAP1FABP4FABP5
SCHEMBL485432 0.86 CXCR2 (0.54) CXCR2CXCR5ERAP1NPC1RAB9A
SCHEMBL4514705 0.86 CXCR2 (0.52) CXCR2CXCR5ERAP1FABP4FABP5
SCHEMBL3933688 0.85 CXCR2 (0.65) CXCR2CXCR5ERAP1FABP4FABP5
SCHEMBL3929933 0.85 CXCR2 (0.60) CXCR2CXCR5ERAP1FABP4FABP5
SCHEMBL4526031 0.85 CXCR2 (0.49) CXCR2ERAP1DRD2DRD3MEN1
SCHEMBL3926776 0.85 CXCR2 (0.49) CXCR2CXCR5ERAP1FABP4FABP5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8501981-B2 CXCR2 inhibitors SANOFI (FR) 2013-08-06 US claimed
US-20090227625-A1 CXCR2 INHIBITORS SANOFI-AVENTIS (FR) 2009-09-10 US claimed
EP-2040688-A1 NEW CXCR2 INHIBITORS Sanofi-Aventis (FR) 2009-04-01 EP claimed
WO-2008000409-A1 NEW CXCR2 INHIBITORS SANOFI-AVENTIS (FR) 2008-01-03 WO claimed
US-8501981-B2 CXCR2 inhibitors SANOFI (FR) 2013-08-06 US disclosed
US-8501981-B2 CXCR2 inhibitors SANOFI (FR) 2013-08-06 US disclosed
US-8501981-B2 CXCR2 inhibitors SANOFI (FR) 2013-08-06 US disclosed
US-20090227625-A1 CXCR2 INHIBITORS SANOFI-AVENTIS (FR) 2009-09-10 US disclosed
US-20090227625-A1 CXCR2 INHIBITORS SANOFI-AVENTIS (FR) 2009-09-10 US disclosed
US-20090227625-A1 CXCR2 INHIBITORS SANOFI-AVENTIS (FR) 2009-09-10 US disclosed
EP-2040688-A1 NEW CXCR2 INHIBITORS Sanofi-Aventis (FR) 2009-04-01 EP disclosed
WO-2008000409-A1 NEW CXCR2 INHIBITORS SANOFI-AVENTIS (FR) 2008-01-03 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-20090227625-A1 CXCR2 INHIBITORS CXCR2, CXCR1, CXCR4 CXCR2 1/4885CXCR5 5/4885ERAP1 2099/4885

“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.