SCHEMBL3928495

SCHEMBL3928495

CCC(C)(NC(=O)c1sc2ccccc2c1OCCOc1ccccc1)C(=O)O

nearest known ligand 0.78

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 5/20 0.78
MAPT P10636 2/20 0.45
RXFP1 Q9HBX9 2/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
NPSR1 Q6W5P4 1/20 0.42
SENP5 Q96HI0 8/20 0.41
SENP2 Q9HC62 8/20 0.41
SENP1 Q9P0U3 8/20 0.41
KMT2A Q03164 1/20 0.40
USP2 O75604 1/20 0.40
MCL1 Q07820 2/20 0.39
BCL2 P10415 1/20 0.39
BCL2L1 Q07817 1/20 0.39
BAD Q92934 1/20 0.39

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
SCHEMBL3928298 0.88 CXCR2 (0.61) CXCR2MAPTRXFP1ALDH1A1LMNA
SCHEMBL3928722 0.88 CXCR2 (1.00) CXCR2MAPTRXFP1ALDH1A1LMNA
SCHEMBL485732 0.80 CXCR2 (0.52) CXCR2SENP5SENP2SENP1USP2
SCHEMBL485260 0.80 SENP2 (0.56) CXCR2SENP5SENP2SENP1USP2
SCHEMBL485674 0.80 CXCR2 (0.51) CXCR2MAPTALDH1A1SENP5SENP2
SCHEMBL4633866 0.78 CXCR2 (0.67) CXCR2MAPTRXFP1ALDH1A1LMNA
SCHEMBL3926644 0.78 CXCR2 (0.83) CXCR2LMNANPSR1KMT2A
SCHEMBL3925368 0.78 CXCR2 (0.83) CXCR2LMNANPSR1KMT2A
SCHEMBL3929169 0.78 CXCR2 (0.83) CXCR2LMNANPSR1KMT2A
SCHEMBL485499 0.78 CXCR2 (0.49) CXCR2SENP5SENP2SENP1

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-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
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 1/4885MAPT 4651/4885RXFP1 74/4885

“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.