SCHEMBL2649237

SCHEMBL2649237

COC(=O)C1(NS(=O)(=O)c2cnc(N)s2)CCC1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.36
SLC6A3 Q01959 1/20 0.36
PLAU P00749 4/20 0.35
PLAT P00750 2/20 0.35
PLG P00747 3/20 0.32
NPSR1 Q6W5P4 1/20 0.32
NLRP3 Q96P20 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CNR2 P34972 2/20 0.31
SLC8A1 P32418 1/20 0.31
MMP1 P03956 1/20 0.31
MMP13 P45452 1/20 0.31
QPCT Q16769 1/20 0.31
QPCTL Q9NXS2 1/20 0.31
HSD11B1 P28845 1/20 0.30

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
SCHEMBL2648632 0.83 PLAU (0.43) ADORA3SLC6A3PLAUPLATSMN1; SMN2
SCHEMBL973472 0.76 NPSR1 (0.33) PLAUPLATNPSR1CNR2SLC8A1
SCHEMBL14026302 0.73 ADAMTS5 (0.50) ADORA3SLC6A3SMN1; SMN2MMP1
SCHEMBL16004927 0.69 CCR5 (0.49) SMN1; SMN2CNR2
SCHEMBL2650487 0.69 ADORA3 (0.39) ADORA3SLC6A3PLAUPLATPLG
SCHEMBL2649270 0.68 ADORA3 (0.50) ADORA3SLC6A3SMN1; SMN2QPCTQPCTL
SCHEMBL2648013 0.68 ADORA3 (0.46) ADORA3SLC6A3NLRP3SMN1; SMN2QPCT
SCHEMBL27618200 0.66 MMP1 (0.46) NPSR1SMN1; SMN2MMP1MMP13HSD11B1
SCHEMBL27859234 0.65 SMN1; SMN2 (0.32) SMN1; SMN2
SCHEMBL2333945 0.65 ALDH1A1 (0.39) NPSR1SMN1; SMN2CNR2MMP1MMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7582769-B2 Dicycloalkyl urea glucokinase activators NOVO NORDISK A/S (DK) 2009-09-01 US disclosed
US-20090118501-A1 Dicycloalkyl Urea Glucokinase Activators NOVO NORDISK A/S (DK) 2009-05-07 US disclosed
EP-1904466-A1 DICYCLOALKYL UREA GLUCOKINASE ACTIVATORS Novo Nordisk A/S (DK) 2008-04-02 EP disclosed
WO-2007006760-A1 DICYCLOALKYL 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 (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-20090118501-A1 Dicycloalkyl Urea Glucokinase Activators GCK, GCKR, UCK2 ADORA3 3095/4885SLC6A3 3145/4885PLAU 405/4885

“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.