SCHEMBL2190963

SCHEMBL2190963

CC(C)(C)OC(=O)N1C[C@H](NC(=S)NC(=O)OCC2c3ccccc3-c3ccccc32)[C@@H](O)C1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.42
DGAT2 Q96PD7 1/20 0.40
USP30 Q70CQ3 1/20 0.39
KMT2A Q03164 2/20 0.39
TLR2 O60603 2/20 0.39
TLR1 Q15399 2/20 0.39
F10 P00742 1/20 0.38
NAMPT P43490 1/20 0.38
CASP1 P29466 1/20 0.38
EPHX2 P34913 1/20 0.37
IDO1 P14902 1/20 0.37
MDM2 Q00987 1/20 0.37

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
SCHEMBL12164667 0.91 BACE1 (0.44) BACE1DGAT2USP30KMT2ATLR2
SCHEMBL5435274 0.86 F10 (0.43) BACE1DGAT2USP30KMT2ATLR2
SCHEMBL5435277 0.86 F10 (0.43) BACE1DGAT2USP30KMT2ATLR2
SCHEMBL21319696 0.82 BACE1 (0.46) BACE1USP30KMT2ATLR2TLR1
SCHEMBL25355246 0.81 BACE1 (0.46) BACE1USP30KMT2ANAMPTEPHX2
SCHEMBL14678450 0.80 BACE1 (0.46) BACE1USP30KMT2ATLR2TLR1
SCHEMBL29569298 0.80 BACE1 (0.46) BACE1USP30KMT2ATLR2TLR1
SCHEMBL742949 0.80 BACE1 (0.46) BACE1USP30KMT2ATLR2TLR1
SCHEMBL6344562 0.80 BACE1 (0.46) BACE1USP30KMT2ATLR2TLR1
SCHEMBL6349287 0.79 BACE1 (0.45) BACE1USP30KMT2ATLR2TLR1

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
EP-2315768-B1 THIENO-PYRIDINE DERIVATIVES AS MEK INHIBITORS UCB BIOPHARMA SPRL (BE) 2017-08-09 EP disclosed
US-8637491-B2 Thieno-pyridine derivatives as MEK inhibitors UCB PHARMA S.A. (BE) 2014-01-28 US disclosed
US-20110172191-A1 THIENO-PYRIDINE DERIVATIVES AS MEK INHIBITORS UCB PHARMA S.A. (BE) 2011-07-14 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-20110172191-A1 THIENO-PYRIDINE DERIVATIVES AS MEK INHIBITORS MAP2K2, MAP2K1, MAP2K3 BACE1 3495/4885DGAT2 4430/4885USP30 2621/4885

“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.