SCHEMBL4602741

SCHEMBL4602741

Nc1ccc(-c2nc3ccc(F)cc3s2)cc1F

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
APP P05067 14/20 0.72
MAOB P27338 1/20 0.55
AXL P30530 1/20 0.55
GFER P55789 1/20 0.55
SULT1A1 P50225 1/20 0.55
KDM4E B2RXH2 1/20 0.53
NPC1 O15118 1/20 0.53
GLA P06280 1/20 0.53
GAA P10253 1/20 0.53
MAPT P10636 1/20 0.53
RAB9A P51151 1/20 0.53
ILK Q13418 1/20 0.52
CCNE1 P24864 1/20 0.52
CDK2 P24941 1/20 0.52
CDK5 Q00535 1/20 0.52
CDK5R1 Q15078 1/20 0.52

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
SCHEMBL30966559 0.88 AHR (0.59) APPGFERSULT1A1KDM4ENPC1
SCHEMBL19985005 0.88 AHR (0.59) APPGFERSULT1A1KDM4ENPC1
SCHEMBL30966572 0.88 AHR (0.59) APPGFERSULT1A1KDM4ENPC1
SCHEMBL5691118 0.86 APP (0.68) APPMAOBAXLGFERSULT1A1
SCHEMBL5691080 0.86 APP (0.71) APPMAOBAXLGFERSULT1A1
SCHEMBL5691307 0.86 APP (0.68) APPMAOBAXLGFERSULT1A1
SCHEMBL5691309 0.86 APP (0.68) APPMAOBAXLGFERSULT1A1
SCHEMBL4636886 0.86 APP (0.68) APPSULT1A1KDM4ENPC1GLA
SCHEMBL13853342 0.84 APP (1.00) APPGFERSULT1A1KDM4ENPC1
SCHEMBL4592891 0.84 APP (0.69) APPKDM4ENPC1GLAGAA

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 2819/4885MAOB 110/4885AXL 72/4885

“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.