SCHEMBL18028

SCHEMBL18028

CCCCOC1CC2COCC1N2C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
PPP5C P53041 1/20 0.38
SPHK1 Q9NYA1 1/20 0.34
PREP P48147 4/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32
USP2 O75604 1/20 0.31
NR1H2 P55055 1/20 0.31
KCNK3 O14649 1/20 0.31
KCNK9 Q9NPC2 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL16240525 0.81 CHRM2 (0.39) CHRM2CHRM1CHRM3PREPSMN1; SMN2
SCHEMBL16240524 0.81 CHRM2 (0.39) CHRM2CHRM1CHRM3PREPSMN1; SMN2
SCHEMBL10299789 0.77 KLK7 (0.47) CHRM2CHRM1CHRM3KCNK3KCNK9
SCHEMBL17489 0.77 KLK7 (0.47) CHRM2CHRM1CHRM3KCNK3KCNK9
SCHEMBL12213468 0.76 CHRM2 (0.47) CHRM2CHRM1CHRM3PREPSMN1; SMN2
SCHEMBL16249773 0.76 CHRM2 (0.44) CHRM2CHRM1CHRM3PREPSMN1; SMN2
SCHEMBL1409774 0.75 CHRM2 (0.50) CHRM2CHRM1CHRM3PREPSMN1; SMN2
SCHEMBL1409111 0.75 CHRM2 (0.50) CHRM2CHRM1CHRM3PREPSMN1; SMN2
SCHEMBL16249775 0.75 CHRM2 (0.43) CHRM2CHRM1CHRM3PREPSMN1; SMN2
SCHEMBL16249789 0.74 CHRM2 (0.45) CHRM2CHRM1CHRM3PREPSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8431563-B2 Compounds that interact with glucokinase regulatory protein for the treatment of diabetes AMGEN INC. (US) 2013-04-30 US disclosed
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-09-06 US disclosed
WO-2012027261-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-03-01 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-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES GCKR, GCK, SLC5A2 CHRM2 4699/4885CHRM1 4848/4885CHRM3 4781/4885

“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.