SCHEMBL17416

SCHEMBL17416

O=S(=O)(c1cccs1)N1CCN[C@@H](Cc2ccccc2)C1

nearest known ligand 0.62

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
POLB P06746 2/20 0.62
TSHR P16473 2/20 0.62
MAPK1 P28482 2/20 0.62
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
GAA P10253 1/20 0.52
PKM P14618 4/20 0.50
GCKR Q14397 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA4 P22748 2/20 0.45
CA9 Q16790 2/20 0.45
RAB9A P51151 1/20 0.44
CCR5 P51681 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL12079068 0.85 ALDH1A1 (0.51) ALDH1A1POLBTSHRMAPK1MEN1
SCHEMBL17508 0.85 ALDH1A1 (0.51) ALDH1A1POLBTSHRMAPK1MEN1
SCHEMBL18668 0.84 ALDH1A1 (0.55) ALDH1A1POLBTSHRMAPK1MEN1
SCHEMBL19484 0.80 ALDH1A1 (0.41) ALDH1A1POLBTSHRMAPK1MEN1
SCHEMBL19072 0.79 NPC1 (0.43) ALDH1A1POLBTSHRMAPK1MEN1
SCHEMBL18037 0.78 PKM (0.59) ALDH1A1POLBTSHRMAPK1MEN1
SCHEMBL20111 0.78 PKM (0.59) ALDH1A1POLBTSHRMAPK1MEN1
SCHEMBL17053 0.77 GCKR (0.53) ALDH1A1POLBTSHRMAPK1MEN1
Hydrochloric Acid SCHEMBL16219 0.77 PKM (0.58) ALDH1A1POLBTSHRMAPK1MEN1
Hydrochloric Acid SCHEMBL31302250 0.77 CA1 (0.50) ALDH1A1POLBTSHRKMT2ASMN1; 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609081-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES Amgen Inc. (US) 2013-07-03 EP 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-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
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
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 ALDH1A1 3293/4885POLB 4613/4885TSHR 2736/4885

“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.