SCHEMBL12078402

SCHEMBL12078402

O=S(=O)(c1cccs1)N1CCN[C@@H](CN2C3COCC2C(OCc2ccccc2)C3)C1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GCK P35557 7/20 0.42
ALDH1A1 P00352 2/20 0.39
POLB P06746 2/20 0.39
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 1/20 0.38
PKM P14618 3/20 0.35
CCR5 P51681 1/20 0.34
MAPT P10636 1/20 0.34
GCKR Q14397 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL18930 0.87 GCK (0.43) GCKALDH1A1MEN1TSHRKMT2A
SCHEMBL12078403 0.81
SCHEMBL12089103 0.78 GCK (0.67) GCKGCKR
SCHEMBL12089784 0.76 GCK (0.56) GCKGCKR
SCHEMBL17627 0.76 GCK (0.77) GCKGCKR
SCHEMBL17508 0.75 ALDH1A1 (0.51) ALDH1A1POLBMEN1TSHRMAPK1
SCHEMBL12079068 0.75 ALDH1A1 (0.51) ALDH1A1POLBMEN1TSHRMAPK1
SCHEMBL12079008 0.75 GCK (0.63) GCKGCKR
SCHEMBL17270 0.75 LTA4H (0.38)
SCHEMBL17416 0.74 ALDH1A1 (0.62) ALDH1A1POLBMEN1TSHRMAPK1

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-8431563-B2 Compounds that interact with glucokinase regulatory protein for the treatment of diabetes AMGEN INC. (US) 2013-04-30 US disclosed
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
US-20120225854-A1 COMPOUNDS THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES AMGEN INC. (US) 2012-09-06 US 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 GCK 2/4885ALDH1A1 3293/4885POLB 4613/4885

“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.