SCHEMBL1241519

SCHEMBL1241519

Fc1ccc(NCC2CCCC2)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
JAK2 O60674 2/20 0.45
JAK1 P23458 2/20 0.45
TYK2 P29597 1/20 0.45
JAK3 P52333 1/20 0.45
BACE1 P56817 3/20 0.43
BACE2 Q9Y5Z0 1/20 0.42
ALDH3A1 P30838 2/20 0.41
ALDH1A1 P00352 1/20 0.41
GALR1 P47211 1/20 0.40
SOS1 Q07889 2/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 1/20 0.40
PABPC1 P11940 1/20 0.40
ITK Q08881 2/20 0.38
CXCR3 P49682 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.36

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
SCHEMBL1241991 0.98 NPC1 (0.48) NPC1RAB9ASMN1; SMN2JAK2JAK1
SCHEMBL1241081 0.96 BACE1 (0.46) NPC1RAB9ASMN1; SMN2JAK2JAK1
SCHEMBL1238687 0.91 BACE1 (0.43) NPC1RAB9ASMN1; SMN2JAK2JAK1
SCHEMBL1241022 0.85 SOS1 (0.54) NPC1RAB9ASMN1; SMN2ALDH1A1SOS1
SCHEMBL1241692 0.85 BACE1 (0.45) NPC1RAB9ASMN1; SMN2JAK2JAK1
SCHEMBL1241697 0.85 BACE1 (0.45) NPC1RAB9ASMN1; SMN2JAK2JAK1
SCHEMBL1240996 0.84 NPC1 (0.44) NPC1RAB9ASMN1; SMN2ALDH3A1MEN1
SCHEMBL1240987 0.82 JAK2 (0.48) JAK2JAK1BACE1
SCHEMBL1241013 0.82 JAK2 (0.46) NPC1RAB9ASMN1; SMN2JAK2JAK1
SCHEMBL1240839 0.81 GALR1 (0.59) BACE1GALR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8586614-B2 Urea glucokinase activators NOVO NORDISK A/S (DK) 2013-11-19 US disclosed
EP-2377856-A1 Urea glucokinase activators NOVO NORDISK A/S (DK) 2011-10-19 EP disclosed
US-20110077234-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2011-03-31 US disclosed
US-7884210-B2 {2-[3-(2-Cyclohex-1-enyl-ethyl)-3-(trans-4-methyl-cyclohexyl)-ureido]-thiazol-5-ylsulfanyl}-acetic acid; for treatment of type 2 diabetes NOVO NORDISK A/S (DK) 2011-02-08 US disclosed
US-20090105482-A1 Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2009-04-23 US disclosed
EP-1904467-A1 UREA GLUCOKINASE ACTIVATORS Novo Nordisk A/S (DK) 2008-04-02 EP disclosed
WO-2007006814-A1 UREA GLUCOKINASE ACTIVATORS NOVO NORDISK A/S (DK) 2007-01-18 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 (2 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-20090105482-A1 Urea Glucokinase Activators GCK, GCKR, HK2 NPC1 4026/4885RAB9A 4155/4885SMN1; SMN2 2536/4885
US-20110077234-A1 Urea Glucokinase Activators GCK, GCKR, HK2 NPC1 4026/4885RAB9A 4155/4885SMN1; SMN2 2536/4885

“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.