SCHEMBL1168971

SCHEMBL1168971

CCC[C@H](N)C(=O)N[C@@H](C)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.64
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
CTDSP1 Q9GZU7 1/20 0.59
HDAC8 Q9BY41 2/20 0.54
CASR P41180 1/20 0.54
MMP9 P14780 2/20 0.50
MMP8 P22894 2/20 0.50
TLR2 O60603 1/20 0.49
MME P08473 1/20 0.48
MAPT P10636 2/20 0.48
MMP14 P50281 1/20 0.48
EPHX1 P07099 2/20 0.48
LMNA P02545 1/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HSD17B10 Q99714 1/20 0.47

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
SCHEMBL27518632 0.85 POLB (0.57) POLBMEN1KMT2ACTDSP1HDAC8
SCHEMBL12012717 0.85 CTSK (0.56) POLBMEN1KMT2ACTDSP1CASR
SCHEMBL27518634 0.85 POLB (0.57) POLBMEN1KMT2ACTDSP1HDAC8
SCHEMBL15338785 0.85 CTSK (0.56) POLBMEN1KMT2ACTDSP1CASR
SCHEMBL8760756 0.84 POLB (0.53) POLBMEN1KMT2ACTDSP1HDAC8
SCHEMBL7313409 0.84 POLB (0.55) POLBMEN1KMT2ACTDSP1HDAC8
SCHEMBL417597 0.84 POLB (0.59) POLBMEN1KMT2ACTDSP1HDAC8
SCHEMBL7313421 0.84 POLB (0.55) POLBMEN1KMT2ACTDSP1HDAC8
SCHEMBL418739 0.84 POLB (0.59) POLBMEN1KMT2ACTDSP1HDAC8
SCHEMBL13338038 0.81 POLB (0.57) POLBMEN1KMT2ACTDSP1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110034513-A1 Heterocyclic Sulfonamide Inhibitors of Beta Amyloid Production WYETH LLC (US) 2011-02-10 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-20110034513-A1 Heterocyclic Sulfonamide Inhibitors of Beta Amyloid Production APP, BACE1, PSEN1 POLB 3197/4885MEN1 1105/4885KMT2A 1866/4885

“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.