SCHEMBL3926067

SCHEMBL3926067

O=C(NC1(C(=O)O)CCOC1)c1ccc2ccccc2c1OCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 4/20 0.56
TRPV1 Q8NER1 1/20 0.38
DRD4 P21917 1/20 0.38
SENP5 Q96HI0 1/20 0.37
SENP2 Q9HC62 1/20 0.37
SENP1 Q9P0U3 1/20 0.37
CXCR5 P32302 6/20 0.37
TACR2 P21452 1/20 0.37
ERAP1 Q9NZ08 1/20 0.37
SLC6A5 Q9Y345 1/20 0.36
P2RX1 P51575 1/20 0.35
P2RX3 P56373 1/20 0.35
P2RX4 Q99571 1/20 0.35
P2RX7 Q99572 1/20 0.35
MMP1 P03956 1/20 0.35
MMP13 P45452 1/20 0.35
PDE2A O00408 1/20 0.34
ALDH1A1 P00352 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL485264 0.90 CXCR2 (0.62) CXCR2TRPV1DRD4SENP5SENP2
SCHEMBL485419 0.88 CXCR2 (0.61) CXCR2TRPV1DRD4SENP5SENP2
SCHEMBL485673 0.88 CXCR2 (0.62) CXCR2TRPV1DRD4SENP5SENP2
SCHEMBL3925954 0.87 CXCR2 (0.61) CXCR2TRPV1DRD4SENP5SENP2
SCHEMBL3934922 0.86 CXCR2 (0.61) CXCR2SENP5SENP2SENP1CXCR5
SCHEMBL3925807 0.86 CXCR2 (0.58) CXCR2TRPV1DRD4SENP5SENP2
SCHEMBL3930274 0.82 CXCR2 (0.80) CXCR2SENP5SENP2SENP1CXCR5
SCHEMBL3926091 0.80 CXCR2 (0.59) CXCR2TRPV1DRD4SENP5SENP2
SCHEMBL3922449 0.79 CXCR2 (0.56) CXCR2TRPV1DRD4SENP5SENP2
SCHEMBL3924948 0.79 CXCR2 (0.78) CXCR2CXCR5TACR2MMP1MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2040690-B1 INHIBITORS OF CXCR2 SANOFI SA (FR) 2014-08-06 EP claimed
US-8552033-B2 Inhibitors of CXCR2 SANOFI (FR) 2013-10-08 US claimed
US-20090215827-A1 INHIBITORS OF CXCR2 SANOFI-AVENTIS (FR) 2009-08-27 US claimed
EP-2040690-A1 INHIBITORS OF CXCR2 Sanofi-Aventis (FR) 2009-04-01 EP claimed
WO-2008000407-A1 INHIBITORS OF CXCR2 SANOFI-AVENTIS (FR) 2008-01-03 WO claimed
EP-2040690-B1 INHIBITORS OF CXCR2 SANOFI SA (FR) 2014-08-06 EP disclosed
EP-2040690-B1 INHIBITORS OF CXCR2 SANOFI SA (FR) 2014-08-06 EP disclosed
US-8552033-B2 Inhibitors of CXCR2 SANOFI (FR) 2013-10-08 US disclosed
US-8552033-B2 Inhibitors of CXCR2 SANOFI (FR) 2013-10-08 US disclosed
US-8552033-B2 Inhibitors of CXCR2 SANOFI (FR) 2013-10-08 US disclosed
US-20090215827-A1 INHIBITORS OF CXCR2 SANOFI-AVENTIS (FR) 2009-08-27 US disclosed
US-20090215827-A1 INHIBITORS OF CXCR2 SANOFI-AVENTIS (FR) 2009-08-27 US disclosed
US-20090215827-A1 INHIBITORS OF CXCR2 SANOFI-AVENTIS (FR) 2009-08-27 US disclosed
EP-2040690-A1 INHIBITORS OF CXCR2 Sanofi-Aventis (FR) 2009-04-01 EP disclosed
WO-2008000407-A1 INHIBITORS OF CXCR2 SANOFI-AVENTIS (FR) 2008-01-03 WO disclosed
WO-2008000407-A1 INHIBITORS OF CXCR2 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-20090215827-A1 INHIBITORS OF CXCR2 CXCR2, CXCR1, CXCR4 CXCR2 1/4885TRPV1 474/4885DRD4 2934/4885

“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.