SCHEMBL12401808

SCHEMBL12401808

CC(C)(NC(=O)c1ccc2ccccc2c1OC[C@H]1CC[C@H](C)CC1)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 13/20 0.54
LMNA P02545 1/20 0.40
KDM4E B2RXH2 1/20 0.39
CXCR5 P32302 1/20 0.39
CNR2 P34972 2/20 0.38
DRD2 P14416 1/20 0.37
DRD3 P35462 1/20 0.37
RAB9A P51151 1/20 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
SCHEMBL484849 1.00 CXCR2 (0.54) CXCR2LMNAKDM4ECXCR5CNR2
SCHEMBL12401814 1.00 CXCR2 (0.54) CXCR2LMNAKDM4ECXCR5CNR2
SCHEMBL485429 0.91 CXCR2 (0.55) CXCR2LMNAKDM4ECNR2RAB9A
SCHEMBL485020 0.85 CXCR2 (0.53) CXCR2LMNAKDM4EDRD2DRD3
SCHEMBL3930560 0.82 CXCR2 (0.66) CXCR2LMNAKDM4ECNR2
SCHEMBL3928798 0.81 CXCR2 (0.60) CXCR2LMNAKDM4ECNR2
SCHEMBL3933194 0.79 CXCR2 (0.66) CXCR2LMNAKDM4ERAB9A
SCHEMBL485119 0.79 CXCR2 (0.61) CXCR2LMNAKDM4ERAB9A
SCHEMBL27693440 0.79 CXCR2 (0.47) CXCR2LMNAKDM4ECNR2DRD2
SCHEMBL3926118 0.78 CXCR2 (0.74) CXCR2LMNAKDM4ERAB9A

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-8283479-B2 CXCR2 inhibitors SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2012-10-09 US disclosed
US-20110184177-A1 CXCR2 INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-07-28 US disclosed
US-7919628-B2 2-[(1-Benzyloxy-naphthalene-2-carbonyl)-amino]-2-methyl-propionic acid; inhibitors of chemokine receptors; treatment or prophylaxis of acute and chronic inflammatory diseases such as atherosclerosis, ischemic or reperfusion injuries, chronic obstructive pulmonary disease, asthma, rheumatoid arthritis SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-04-05 US disclosed
US-7919628-B2 2-[(1-Benzyloxy-naphthalene-2-carbonyl)-amino]-2-methyl-propionic acid; inhibitors of chemokine receptors; treatment or prophylaxis of acute and chronic inflammatory diseases such as atherosclerosis, ischemic or reperfusion injuries, chronic obstructive pulmonary disease, asthma, rheumatoid arthritis SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-04-05 US disclosed
US-20080090854-A1 CXCR2 INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-04-17 US disclosed
US-20080090854-A1 CXCR2 INHIBITORS SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-04-17 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 (2 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-20110184177-A1 CXCR2 INHIBITORS CXCR2, CXCR1, CXCR4 CXCR2 1/4885LMNA 4616/4885KDM4E 3892/4885
US-20080090854-A1 CXCR2 INHIBITORS CXCR2, CXCR1, CXCR4 CXCR2 1/4885LMNA 4616/4885KDM4E 3892/4885

“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.