SCHEMBL10174797

SCHEMBL10174797

Cc1ccccc1C(=O)c1cccs1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.66
WNT3A P56704 1/20 0.66
ALOX15 P16050 2/20 0.66
LMNA P02545 1/20 0.66
MAPT P10636 4/20 0.60
THRB P10828 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
PKM P14618 1/20 0.57
HPGDS O60760 1/20 0.56
ALDH1A1 P00352 3/20 0.55
PSMD14 O00487 1/20 0.55
MMP2 P08253 1/20 0.55
HSD17B10 Q99714 1/20 0.55
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
DAO P14920 1/20 0.48
CYP1A2 P05177 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
CYP3A4 P08684 1/20 0.48

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
SCHEMBL9148337 0.86 LMNA (0.85) CTNNB1WNT3AALOX15LMNAMAPT
SCHEMBL256810 0.86 ALOX15 (0.57) CTNNB1WNT3AALOX15LMNAMAPT
SCHEMBL11705393 0.83 ALOX15 (0.54) CTNNB1WNT3AALOX15LMNAMAPT
SCHEMBL9364002 0.81 ALOX15 (0.71) CTNNB1WNT3AALOX15LMNAMAPT
SCHEMBL11930062 0.80 ALOX15 (0.64) CTNNB1WNT3AALOX15LMNAMAPT
SCHEMBL15969091 0.80 CTNNB1 (1.00) CTNNB1WNT3ALMNAMAPTTHRB
SCHEMBL6449126 0.80 MAPT (0.71) CTNNB1WNT3AMAPTTHRBSMN1; SMN2
SCHEMBL3859942 0.79 ALOX15 (1.00) ALOX15LMNAMAPTSMN1; SMN2HPGDS
SCHEMBL10618289 0.79 ALOX15 (0.68) ALOX15LMNAMAPTSMN1; SMN2PKM
SCHEMBL11913211 0.79 ADORA1 (0.57) CTNNB1WNT3AALOX15LMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE43298-E1 Peptides as NS3-serine protease inhibitors of hepatitis C virus SCHERING CORPORATION (US) 2012-04-03 US disclosed
US-20110117057-A1 NOVEL PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS SCHERING CORPORATION (US) 2011-05-19 US disclosed
US-7595299-B2 Peptides as NS3-serine protease inhibitors of hepatitis C virus SCHERING CORPORATION (US) 2009-09-29 US disclosed
US-7592316-B2 Peptides as NS3-serine protease inhibitors of hepatitis C virus SCHERING CORPORATION (US) 2009-09-22 US disclosed
US-7592419-B2 Macrocyclic inhibitors of hepatitis C virus NS3-serine protease SCHERING CORPORATION (US) 2009-09-22 US disclosed
EP-1343807-B1 DIARYL PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITS C VIRUS SCHERING CORP (US) 2009-04-29 EP disclosed
US-7449447-B2 Peptidomimetic NS3-serine protease inhibitors of hepatitis C virus SCHERING CORPORATION (US) 2008-11-11 US disclosed
US-20070232549-A1 Novel peptides as NS3-serine protease inhibitors of hepatitis C virus SCHERING CORPORATION 2007-10-04 US disclosed
US-7244721-B2 Peptides as NS3-serine protease inhibitors of hepatitis C virus SCHERING CORPORATION (US) 2007-07-17 US disclosed
US-20070032433-A1 Novel peptides as NS3-serine protease inhibitors of hepatitis C virus SCHERING CORPORATION CORVAS INTERNATIONAL, LTD. 2007-02-08 US disclosed
US-7169760-B2 Peptides as NS3-serine protease inhibitors of hepatitis C virus SCHERING CORPORATION (US) 2007-01-30 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 (3 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-20070232549-A1 Novel peptides as NS3-serine protease inhibitors of hepatitis C virus HPN, TMPRSS15, VIP CTNNB1 1524/4885WNT3A 1904/4885ALOX15 2957/4885
US-20110117057-A1 NOVEL PEPTIDES AS NS3-SERINE PROTEASE INHIBITORS OF HEPATITIS C VIRUS HPN, TMPRSS15, VIP CTNNB1 1524/4885WNT3A 1904/4885ALOX15 2957/4885
US-20070032433-A1 Novel peptides as NS3-serine protease inhibitors of hepatitis C virus HPN, TMPRSS15, VIP CTNNB1 1524/4885WNT3A 1904/4885ALOX15 2957/4885

“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.