SCHEMBL4604123

SCHEMBL4604123

CC(=O)c1sc2ccccc2c1OCCCCCC(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR2 P25025 1/20 0.49
KMT2A Q03164 2/20 0.48
F2 P00734 1/20 0.48
MAPT P10636 1/20 0.48
SENP5 Q96HI0 5/20 0.44
SENP2 Q9HC62 5/20 0.44
SENP1 Q9P0U3 5/20 0.44
USP2 O75604 1/20 0.44
ALDH1A1 P00352 3/20 0.43
LMNA P02545 2/20 0.43
PRNP P04156 1/20 0.43
RECQL P46063 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
PTPN2 P17706 1/20 0.42
PTPN1 P18031 1/20 0.42
LTB4R Q15722 3/20 0.42
PPARA Q07869 2/20 0.41
BCL2 P10415 2/20 0.41
BCL2L1 Q07817 2/20 0.41
MCL1 Q07820 2/20 0.41

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
SCHEMBL4605692 0.99 CXCR2 (0.50) CXCR2KMT2AF2MAPTSENP5
SCHEMBL4632963 0.86 CXCR2 (0.47) CXCR2KMT2AMAPTSENP5SENP2
SCHEMBL4605238 0.86 CXCR2 (0.52) CXCR2KMT2AMAPTSENP5SENP2
SCHEMBL4604559 0.86 PPARA (0.52) CXCR2KMT2ASENP5SENP2SENP1
SCHEMBL4633542 0.85 CXCR2 (0.47) CXCR2KMT2AMAPTSENP5SENP2
SCHEMBL4604246 0.85 CXCR2 (0.53) CXCR2KMT2AMAPTSENP5SENP2
SCHEMBL4603929 0.85 PPARA (0.53) CXCR2KMT2ASENP5SENP2SENP1
SCHEMBL4604056 0.82 PTPN1 (0.60) CXCR2KMT2AF2MAPTSENP5
SCHEMBL4606256 0.81 GABRA1 (0.53) CXCR2KMT2AMAPTSENP5SENP2
SCHEMBL4604985 0.81 CXCR2 (0.54) CXCR2KMT2AF2MAPTLMNA

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 3 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

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 1633/4885KMT2A 2846/4885F2 418/4885

“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.