SCHEMBL13619836

SCHEMBL13619836

CCOC(=O)CC(=O)C(CCC(C)C)c1ccc(F)cn1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCR1 P25024 2/20 0.37
CXCR2 P25025 2/20 0.37
APLNR P35414 2/20 0.37
MAPT P10636 5/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 2/20 0.36
LMNA P02545 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
POLB P06746 3/20 0.36
GAA P10253 2/20 0.35
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTPN1 P18031 1/20 0.34
ALDH1A1 P00352 1/20 0.33
MAPK1 P28482 1/20 0.33
MAOB P27338 1/20 0.33

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
SCHEMBL13619859 0.88 KDM4E (0.36) MAPTMEN1KMT2AGAAKDM4E
SCHEMBL12627693 0.86 CXCR1 (0.36) CXCR1CXCR2APLNRMAPTMEN1
SCHEMBL12627634 0.83 PPARG (0.43) CXCR1CXCR2APLNRMAPTMEN1
SCHEMBL13619841 0.82 APLNR (0.38) CXCR1CXCR2APLNRMAPTMEN1
SCHEMBL12627649 0.81 CXCR1 (0.38) CXCR1CXCR2APLNRMAPTMEN1
SCHEMBL13619592 0.81 SMN1; SMN2 (0.48) MAPTMEN1KMT2ACYP1A2LMNA
SCHEMBL12627655 0.79 MAOB (0.37) CXCR1CXCR2APLNRLMNAPOLB
SCHEMBL13619840 0.78 APLNR (0.44) CXCR1CXCR2APLNRNPSR1GAA
SCHEMBL13619874 0.76 MEN1 (0.41) MAPTMEN1KMT2ACYP1A2LMNA
SCHEMBL16797554 0.74 APLNR (0.46) APLNRMAPTMEN1KMT2ACYP1A2

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
WO-2009134616-A2 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2009-11-05 WO disclosed
US-20090257979-A1 Novel Inhibitors of Hepatitis C Virus Replication INTERMUNE, INC. (US) 2009-10-15 US disclosed
US-20090257979-A1 Novel Inhibitors of Hepatitis C Virus Replication INTERMUNE, INC. (US) 2009-10-15 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-20090257979-A1 Novel Inhibitors of Hepatitis C Virus Replication EIF2AK2, HAVCR2, HDGF CXCR1 800/4885CXCR2 884/4885APLNR 3713/4885

“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.