SCHEMBL18318

SCHEMBL18318

C[C@H]1CNCCN1c1ccc(C(C)(O)C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 5/20 0.43
RAD52 P43351 1/20 0.42
GCKR Q14397 8/20 0.39
GCK P35557 6/20 0.36
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35

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
SCHEMBL17181 1.00 HSD11B1 (0.43) HSD11B1RAD52GCKRGCKHTR2A
SCHEMBL12078657 1.00 HSD11B1 (0.43) HSD11B1RAD52GCKRGCKHTR2A
Hydrochloric Acid SCHEMBL16799 0.99 RAD52 (0.44) HSD11B1RAD52GCKRGCKHTR2A
Hydrochloric Acid SCHEMBL29627 0.99 RAD52 (0.44) HSD11B1RAD52GCKRGCKHTR2A
SCHEMBL18202 0.88 GCKR (0.47) RAD52GCKRGCKHTR2C
SCHEMBL19294 0.88 GCKR (0.47) RAD52GCKRGCKHTR2C
Hydrochloric Acid SCHEMBL12078152 0.86 GCKR (0.46) RAD52GCKRGCKHTR2C
Hydrochloric Acid SCHEMBL16351 0.86 GCKR (0.46) RAD52GCKRGCKHTR2C
Hydrochloric Acid SCHEMBL16350 0.86 GCKR (0.46) RAD52GCKRGCKHTR2C
Hydrochloric Acid SCHEMBL12078148 0.86 GCKR (0.46) RAD52GCKRGCKHTR2C

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
EP-2609081-A1 SULFONYLPIPERAZINE DERIVATIVES THAT INTERACT WITH GLUCOKINASE REGULATORY PROTEIN FOR THE TREATMENT OF DIABETES Amgen Inc. (US) 2013-07-03 EP 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