SCHEMBL1653274

SCHEMBL1653274

CCCNC(=O)[C@@H](N)CSCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.49
ALDH1A1 P00352 2/20 0.48
TLR2 O60603 1/20 0.48
ACE P12821 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
HPGD P15428 1/20 0.44
LMNA P02545 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 1/20 0.43
POLB P06746 1/20 0.43

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
SCHEMBL12888845 0.88 ALDH1A1 (0.51) METAP2ALDH1A1TLR2ACEHPGD
SCHEMBL3592883 0.87 ACE (0.47) METAP2ALDH1A1ACEHPGDLMNA
SCHEMBL3577967 0.85 KIF11 (0.46) METAP2ALDH1A1TLR2ACEHPGD
SCHEMBL3577970 0.85 KIF11 (0.46) METAP2ALDH1A1TLR2ACEHPGD
SCHEMBL7544294 0.83 CTSC (0.51) METAP2ACE
SCHEMBL3503447 0.82 GLO1 (0.53) METAP2ALDH1A1ACEHPGDMAPT
SCHEMBL11880817 0.82 GLO1 (0.53) METAP2ALDH1A1ACEHPGDMAPT
SCHEMBL20629402 0.82 METAP2 (0.49) METAP2TLR2ACE
SCHEMBL2311329 0.82 ALPI (0.56) L3MBTL1POLB
SCHEMBL987883 0.82 ALPI (0.56) L3MBTL1POLB

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
US-8957070-B2 Glucokinase activator compounds, methods of activating glucokinase and methods of treating diabetes and obesity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-02-17 US disclosed
EP-1873144-B1 FUSED HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL (JP) 2014-07-23 EP disclosed
EP-2308839-A1 Fused heterocyclic compounds Takeda Pharmaceutical Company Limited (JP) 2011-04-13 EP disclosed
US-20090247746-A1 Fused heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-01 US disclosed
EP-1873144-A1 FUSED HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2008-01-02 EP 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-20090247746-A1 Fused heterocyclic compound GCKR, GCK, GPR119 METAP2 815/4885ALDH1A1 372/4885TLR2 3786/4885

“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.