SCHEMBL4592891

SCHEMBL4592891

Nc1ccc(-c2nc3ccccc3s2)cc1F

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 7/20 0.69
MMP9 P14780 2/20 0.62
MMP8 P22894 2/20 0.62
RAB9A P51151 8/20 0.61
NPC1 O15118 7/20 0.61
KDM4E B2RXH2 6/20 0.61
MEN1 O00255 4/20 0.61
KMT2A Q03164 4/20 0.61
ALDH1A1 P00352 4/20 0.61
MAPT P10636 4/20 0.61
NFKB1 P19838 3/20 0.61
NFKB2 Q00653 3/20 0.61
RELA Q04206 3/20 0.61
SMN1; SMN2 Q16637 4/20 0.54
LMNA P02545 3/20 0.54
GAA P10253 3/20 0.54
GLA P06280 2/20 0.54
TDP1 Q9NUW8 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
TP53 P04637 2/20 0.54

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
SCHEMBL7836371 0.86 APP (0.75) APPMMP9MMP8RAB9ANPC1
SCHEMBL8397690 0.84 APP (0.73) APPMMP9MMP8RAB9ANPC1
SCHEMBL30966559 0.84 AHR (0.59) APPRAB9ANPC1KDM4EMEN1
SCHEMBL30966572 0.84 AHR (0.59) APPRAB9ANPC1KDM4EMEN1
SCHEMBL19985005 0.84 AHR (0.59) APPRAB9ANPC1KDM4EMEN1
SCHEMBL4602741 0.84 APP (0.72) APPRAB9ANPC1KDM4EMAPT
SCHEMBL12227064 0.82 APP (0.69) APPMMP9MMP8RAB9ANPC1
SCHEMBL4592655 0.82 KDM4E (0.64) APPMMP9MMP8RAB9ANPC1
SCHEMBL15952333 0.82 APP (0.55) APPMMP9MMP8RAB9ANPC1
SCHEMBL1978135 0.82 APP (0.69) APPMMP9MMP8RAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910349-A1 2-ARYLBENZOTHIAZOLES AND USES THEREOF 4SC AG (DE) 2008-04-16 EP disclosed
WO-2007009524-A1 2-ARYLBENZOTHIAZOLES AND USES THEREOF 4SC AG (DE) 2007-01-25 WO disclosed
US-20070021446-A1 2-arylbenzothiazole analogues and uses thereof 4SC AG (DE) 2007-01-25 US disclosed
EP-1746096-A1 2-Arylbenzothiazole analogues and uses thereof in the treatment of cancer 4SC AG (DE) 2007-01-24 EP disclosed
EP-1746096-A1 2-Arylbenzothiazole analogues and uses thereof in the treatment of cancer 4SC AG (DE) 2007-01-24 EP 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-20070021446-A1 2-arylbenzothiazole analogues and uses thereof NR2E1, NR2E3, NR0B2 APP 2819/4885MMP9 4343/4885MMP8 3150/4885

“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.