SCHEMBL1241081

SCHEMBL1241081

Fc1ccc(NCC2CCC2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 3/20 0.46
JAK2 O60674 2/20 0.45
JAK1 P23458 2/20 0.45
TYK2 P29597 1/20 0.45
JAK3 P52333 1/20 0.45
SOS1 Q07889 2/20 0.43
BACE2 Q9Y5Z0 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPT P10636 1/20 0.40
PABPC1 P11940 1/20 0.40
ALDH3A1 P30838 2/20 0.38
ALDH1A1 P00352 2/20 0.38
GALR1 P47211 1/20 0.38
MAPK1 P28482 1/20 0.36
POLB P06746 2/20 0.36
CNR2 P34972 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
SCHEMBL1241519 0.96 NPC1 (0.45) BACE1JAK2JAK1TYK2JAK3
SCHEMBL1241991 0.95 NPC1 (0.48) BACE1JAK2JAK1TYK2JAK3
SCHEMBL1238687 0.88 BACE1 (0.43) BACE1JAK2JAK1TYK2JAK3
SCHEMBL1241697 0.85 BACE1 (0.45) BACE1JAK2JAK1TYK2JAK3
SCHEMBL1241692 0.85 BACE1 (0.45) BACE1JAK2JAK1TYK2JAK3
SCHEMBL1241013 0.82 JAK2 (0.46) BACE1JAK2JAK1TYK2JAK3
SCHEMBL1241022 0.81 SOS1 (0.54) SOS1NPC1RAB9ASMN1; SMN2MEN1
SCHEMBL1241010 0.81 CNR2 (0.46) BACE1JAK2JAK1TYK2JAK3
SCHEMBL1240996 0.81 NPC1 (0.44) NPC1RAB9ASMN1; SMN2MEN1KMT2A
SCHEMBL1240987 0.79 JAK2 (0.48) BACE1JAK2JAK1CNR2

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 6 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
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 BACE1 2492/4885JAK2 3117/4885JAK1 4116/4885
US-20110077234-A1 Urea Glucokinase Activators GCK, GCKR, HK2 BACE1 2492/4885JAK2 3117/4885JAK1 4116/4885

“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.