SCHEMBL4606015

SCHEMBL4606015

CC(=O)c1sc2ccccc2c1OCCOc1ccc(CC(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 1/20 0.56
MAPT P10636 3/20 0.47
KMT2A Q03164 2/20 0.47
F2 P00734 1/20 0.47
RXFP1 Q9HBX9 2/20 0.45
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
SENP5 Q96HI0 6/20 0.44
SENP2 Q9HC62 6/20 0.44
SENP1 Q9P0U3 6/20 0.44
USP2 O75604 1/20 0.44
LTB4R Q15722 2/20 0.43
LTB4R2 Q9NPC1 2/20 0.43
PLA2G4B P0C869 1/20 0.42
NPSR1 Q6W5P4 1/20 0.41
ALOX15 P16050 1/20 0.41
EDNRA P25101 1/20 0.40
BCL2 P10415 1/20 0.40
BCL2L1 Q07817 1/20 0.40
MCL1 Q07820 1/20 0.40

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
SCHEMBL4604985 0.89 CXCR2 (0.54) CXCR2MAPTKMT2AF2LMNA
SCHEMBL4604550 0.88 CXCR2 (0.59) CXCR2MAPTKMT2ARXFP1ALDH1A1
SCHEMBL4634470 0.88 CXCR2 (0.53) CXCR2MAPTRXFP1ALDH1A1LMNA
SCHEMBL4634975 0.81 CXCR2 (0.52) CXCR2MAPTRXFP1ALDH1A1LMNA
SCHEMBL4635005 0.80 CXCR2 (0.46) CXCR2MAPTKMT2ARXFP1ALDH1A1
SCHEMBL4605692 0.79 CXCR2 (0.50) CXCR2MAPTKMT2AF2RXFP1
SCHEMBL4635007 0.79 CXCR2 (0.49) CXCR2KMT2ARXFP1ALDH1A1LMNA
SCHEMBL4604056 0.79 PTPN1 (0.60) CXCR2MAPTKMT2AF2ALDH1A1
SCHEMBL4633866 0.79 CXCR2 (0.67) CXCR2MAPTKMT2ARXFP1ALDH1A1
SCHEMBL4604123 0.78 CXCR2 (0.49) CXCR2MAPTKMT2AF2RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1685122-B1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GMBH (DE) 2008-07-09 EP disclosed
US-7371774-B2 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2008-05-13 US disclosed
US-20070066680-A1 Benzofurans and benzothiophenes MERCK PATENT GMBH (DE) 2007-03-22 US disclosed
EP-1685122-A1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GmbH (DE) 2006-08-02 EP disclosed
WO-2005054226-A1 BENZOFURANS AND BENZOTHIOPHENES MERCK PATENT GMBH (DE) 2005-06-16 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-20070066680-A1 Benzofurans and benzothiophenes INSR, GPR119, IGF1R CXCR2 1633/4885MAPT 1767/4885KMT2A 2846/4885

“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.