SCHEMBL8283153

SCHEMBL8283153

CCOC(=O)C1(Cc2ccccc2)CCC(F)(F)CC1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.56
KMT2A Q03164 4/20 0.56
KDM4E B2RXH2 3/20 0.56
MEN1 O00255 3/20 0.56
ALDH1A1 P00352 3/20 0.54
MAPT P10636 1/20 0.54
HTT P42858 1/20 0.53
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
GAA P10253 2/20 0.52
MAPK1 P28482 1/20 0.52
NPSR1 Q6W5P4 1/20 0.50

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
SCHEMBL6627628 0.87 KDM4E (0.64) LMNASMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL3718479 0.87 KDM4E (0.64) LMNASMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL14074899 0.85 KDM4E (0.62) LMNASMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL12140572 0.84 LMNA (0.45) LMNASMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL13435159 0.83 LMNA (0.59) LMNASMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL962133 0.83 OPRM1 (0.62) LMNASMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL1668104 0.82 LMNA (0.56) LMNASMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL31670922 0.82 KMT2A (0.48) LMNAKMT2AKDM4EMEN1ALDH1A1
SCHEMBL12946592 0.82 SMN1; SMN2 (0.71) LMNASMN1; SMN2KMT2AKDM4EMEN1
SCHEMBL16864106 0.82 LMNA (0.72) LMNASMN1; SMN2KMT2AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7423058-B2 Inhibitors of hepatitis C virus NS3 protease SCHERING CORPORATION (US) 2008-09-09 US disclosed
US-7423058-B2 Inhibitors of hepatitis C virus NS3 protease SCHERING CORPORATION (US) 2008-09-09 US disclosed
US-20070142301-A1 Novel inhibitors of Hepatitis C virus NS3 protease MERCK SHARP & DOHME CORP. 2007-06-21 US disclosed
US-20070142301-A1 Novel inhibitors of Hepatitis C virus NS3 protease MERCK SHARP & DOHME CORP. 2007-06-21 US disclosed
US-7205330-B2 Inhibitors of hepatitis C virus NS3 protease SCHERING CORPORATION (US) 2007-04-17 US disclosed
US-7205330-B2 Inhibitors of hepatitis C virus NS3 protease SCHERING CORPORATION (US) 2007-04-17 US disclosed
WO-2005085275-A1 INHIBITORS OF HEPATITIS C VIRUS NS3 PROTEASE SCHERING CORPORATION (US) 2005-09-15 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-20070142301-A1 Novel inhibitors of Hepatitis C virus NS3 protease HAVCR2, RNASE1, SERPINB1 LMNA 3585/4885SMN1; SMN2 3962/4885KMT2A 2559/4885

“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.