SCHEMBL1127873

SCHEMBL1127873

CCOC(=O)C(Cc1ccc(S(C)(=O)=O)cc1)c1ccccn1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.49
GAA P10253 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
GPR119 Q8TDV5 3/20 0.41
PGR P06401 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
PTGS1 P23219 1/20 0.40
SLC6A2 P23975 1/20 0.40
LMNA P02545 1/20 0.40
PKM P14618 1/20 0.39
BACE1 P56817 1/20 0.39

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
SCHEMBL1127436 0.91 MEN1 (0.46) MEN1GAAKMT2ASMN1; SMN2KDM4E
SCHEMBL1127424 0.86 MEN1 (0.57) MEN1GAAKMT2ASMN1; SMN2KDM4E
SCHEMBL1127419 0.85 KDM4E (0.42) MEN1KMT2AKDM4EALDH1A1GPR119
SCHEMBL1127707 0.84 KMT2A (0.52) MEN1GAAKMT2ASMN1; SMN2KDM4E
SCHEMBL1127513 0.80 KMT2A (0.50) MEN1GAAKMT2ASMN1; SMN2KDM4E
SCHEMBL3797835 0.79 MEN1 (0.49) MEN1GAAKMT2ASMN1; SMN2ALDH1A1
SCHEMBL1127442 0.78 KDM4E (0.37) MEN1GAAKMT2ASMN1; SMN2KDM4E
SCHEMBL11532666 0.78 MEN1 (0.57) MEN1GAAKMT2ASMN1; SMN2KDM4E
SCHEMBL1127494 0.78 KMT2A (0.51) MEN1GAAKMT2ASMN1; SMN2KDM4E
SCHEMBL1127316 0.77 MEN1 (0.52) MEN1GAAKMT2ASMN1; SMN2KDM4E

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-2283002-A2 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION Intermune, Inc. (US) 2011-02-16 EP disclosed
WO-2009134616-A2 NOVEL INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2009-11-05 WO disclosed
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 MEN1 4723/4885GAA 799/4885KMT2A 2735/4885

“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.