SCHEMBL10098521

SCHEMBL10098521

NC(=O)CCC(N)C(=O)NCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 1/20 0.51
MMP8 P22894 2/20 0.49
EGFR P00533 2/20 0.48
SRC P12931 1/20 0.48
KMT2A Q03164 2/20 0.48
GAA P10253 1/20 0.47
MMP2 P08253 1/20 0.47
CYP2D6 P10635 2/20 0.47
MEN1 O00255 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
CYP2C19 P33261 1/20 0.46
SPHK1 Q9NYA1 1/20 0.46

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
SCHEMBL16103221 1.00 SLC1A1 (0.51) SLC1A1MMP8EGFRSRCKMT2A
SCHEMBL13151621 0.92 MMP2 (0.52) SLC1A1MMP8EGFRSRCKMT2A
SCHEMBL16103702 0.92 MMP2 (0.52) SLC1A1MMP8EGFRSRCKMT2A
SCHEMBL29313122 0.88 SLC1A1 (0.66) SLC1A1MMP8KMT2AGAAMMP2
SCHEMBL5788086 0.86 KMT2A (0.55) SLC1A1MMP8KMT2AMEN1
SCHEMBL16103393 0.85 MAPT (0.54) GAASPHK1
SCHEMBL13151584 0.85 MAPT (0.54) GAASPHK1
SCHEMBL7524502 0.84 ALDH1A1 (0.55) SLC1A1MMP8EGFRSRCKMT2A
SCHEMBL30120748 0.84 MMP2 (0.56) SLC1A1MMP8EGFRSRCKMT2A
SCHEMBL5555507 0.84 SLC1A1 (0.57) SLC1A1MMP8EGFRSRCKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120035114-A1 INHIBITORS OF STAT3 AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2012-02-09 US disclosed
WO-2010118309-A2 INHIBITORS OF STAT3 AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2010-10-14 WO 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-20120035114-A1 INHIBITORS OF STAT3 AND USES THEREOF STAT3, JAK2, STAT6 SLC1A1 3980/4885MMP8 1199/4885EGFR 251/4885

“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.