SCHEMBL2373450

SCHEMBL2373450

O=C([C@H](Cc1ccccc1)N(Cc1ccc(N2CCOCC2)nc1)C(=O)/C=C/c1ccc(C(F)(F)F)nc1)N1CCC(Cc2ccccc2)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.37
TNF P01375 1/20 0.37
STAT3 P40763 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NOD2 Q9HC29 1/20 0.37
NOD1 Q9Y239 1/20 0.37
GAA P10253 3/20 0.37
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
KDM4E B2RXH2 3/20 0.36
SFRP1 Q8N474 1/20 0.36
MAPT P10636 2/20 0.36
P2RX7 Q99572 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL2373456 1.00 LMNA (0.37) LMNATNFSTAT3SMN1; SMN2NOD2
SCHEMBL2373454 1.00 LMNA (0.37) LMNATNFSTAT3SMN1; SMN2NOD2
SCHEMBL2374023 0.93 GAA (0.39) LMNASTAT3SMN1; SMN2GAAGRIN2D
SCHEMBL2374018 0.93 GAA (0.39) LMNASTAT3SMN1; SMN2GAAGRIN2D
SCHEMBL2374025 0.93 GAA (0.39) LMNASTAT3SMN1; SMN2GAAGRIN2D
SCHEMBL2373754 0.89 LMNA (0.49) LMNAGAAGRIN2DGRIN3BGRIN1
SCHEMBL2373756 0.89 LMNA (0.49) LMNAGAAGRIN2DGRIN3BGRIN1
SCHEMBL2373752 0.89 LMNA (0.49) LMNAGAAGRIN2DGRIN3BGRIN1
SCHEMBL2339998 0.89 LMNA (0.44) LMNAGAAGRIN2DGRIN3BGRIN1
SCHEMBL2340003 0.89 LMNA (0.44) LMNAGAAGRIN2DGRIN3BGRIN1

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-20110224210-A1 NOVEL BIS-AMIDES AS ANTI-MALARIAL AGENTS ACTELION PHARMACEUTICALS LTD. (CH) 2011-09-15 US claimed
US-20110224210-A1 NOVEL BIS-AMIDES AS ANTI-MALARIAL AGENTS ACTELION PHARMACEUTICALS LTD. (CH) 2011-09-15 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-20110224210-A1 NOVEL BIS-AMIDES AS ANTI-MALARIAL AGENTS CTSA, BECN1, HDAC6 LMNA 1347/4885TNF 4340/4885STAT3 4471/4885

“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.