SCHEMBL17031

SCHEMBL17031

CC(O)(c1ccc(N2CCNC[C@@H]2Cc2ccccc2)cc1)C(F)(F)F

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 13/20 0.65
SLC6A3 Q01959 13/20 0.65
SLC6A2 P23975 12/20 0.65
CYP2D6 P10635 2/20 0.50
MITF O75030 1/20 0.47
GCKR Q14397 3/20 0.45
ADRB1 P08588 2/20 0.40

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
SCHEMBL12089894 0.89 SLC6A4 (0.71) SLC6A4SLC6A3SLC6A2CYP2D6MITF
SCHEMBL2951055 0.80 SLC6A4 (1.00) SLC6A4SLC6A3SLC6A2CYP2D6MITF
SCHEMBL6658178 0.80 SLC6A4 (0.81) SLC6A4SLC6A3SLC6A2CYP2D6MITF
SCHEMBL16824 0.79 GCKR (0.51) GCKR
SCHEMBL17181 0.78 HSD11B1 (0.43) GCKR
SCHEMBL12078657 0.78 HSD11B1 (0.43) GCKR
SCHEMBL18318 0.78 HSD11B1 (0.43) GCKR
Hydrochloric Acid SCHEMBL16799 0.77 RAD52 (0.44) GCKR
Hydrochloric Acid SCHEMBL29627 0.77 RAD52 (0.44) GCKR
SCHEMBL588544 0.77 SLC6A4 (0.81) SLC6A4SLC6A3SLC6A2CYP2D6MITF

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 7 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-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 SLC6A4 3143/4885SLC6A3 3199/4885SLC6A2 3131/4885

“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.