SCHEMBL11913699

SCHEMBL11913699

O=[N+]([O-])c1ccc(Cl)c(-c2ccc(/C=N/Nc3nc(Nc4ccc(F)cc4)nc(N4CCOCC4)n3)o2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 12/20 0.55
▸ MEN1 O00255 10/20 0.55
▸ KMT2A Q03164 10/20 0.55
▸ ALDH1A1 P00352 9/20 0.55
▸ SMN1; SMN2 Q16637 3/20 0.55
▸ NPC1 O15118 2/20 0.55
▸ RAB9A P51151 2/20 0.55
▸ TLR9 Q9NR96 1/20 0.55
▸ MCL1 Q07820 1/20 0.55
▸ BLM P54132 1/20 0.53
▸ HTT P42858 7/20 0.53
▸ CRHBP P24387 2/20 0.53
▸ CRHR2 Q13324 2/20 0.53
▸ GAA P10253 2/20 0.53
▸ RECQL P46063 1/20 0.53
▸ LMNA P02545 5/20 0.52
▸ TDP1 Q9NUW8 2/20 0.52
▸ L3MBTL1 Q9Y468 4/20 0.51
▸ NPSR1 Q6W5P4 4/20 0.47
▸ CYP1A2 P05177 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
SCHEMBL11918204 0.88 MAPT (0.51) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL13942699 0.83 KMT2A (0.77) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL8239298 0.80 KMT2A (0.60) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL12417212 0.79 MAPT (0.63) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11913670 0.79 MAPT (0.58) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL13944051 0.78 LMNA (0.70) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL12417208 0.76 MAPT (0.59) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL8239208 0.76 HTT (0.71) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL12417173 0.75 MAPT (0.56) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL13576487 0.75 LMNA (0.81) MAPTMEN1KMT2AALDH1A1SMN1; SMN2

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-20120202814-A1 COMPOUNDS WITH DDX3 INHIBITORY ACTIVITY AND USES THEREOF UNIVERSITÀ DEGLI STUDI DI SIENA (IT) 2012-08-09 — — US disclosed
WO-2011039735-A2 COMPOUNDS WITH DDX3 INHIBITORY ACTIVITY AND USES THEREOF CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 2011-04-07 — — 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-20120202814-A1 COMPOUNDS WITH DDX3 INHIBITORY ACTIVITY AND USES THEREOF DDX3X, DDX21, DDX39B MAPT 4074/4885MEN1 1855/4885KMT2A 2610/4885

“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.

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