SCHEMBL21828535

SCHEMBL21828535

CC(C)N(C(=O)OC1CCN(c2cccnc2)CC1)C(C)C

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.51
NPY5R Q15761 1/20 0.47
HRH3 Q9Y5N1 6/20 0.46
FFAR1 O14842 1/20 0.44
TRPV6 Q9H1D0 1/20 0.42
CHRNB2 P17787 3/20 0.41
CHRNA4 P43681 3/20 0.41
CHRNB4 P30926 2/20 0.41
CHRNA3 P32297 2/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CHRM4 P08173 1/20 0.41

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
SCHEMBL28447997 0.81 GPR119 (0.53) GPR119NPY5RHRH3FFAR1TRPV6
SCHEMBL31329886 0.76 GPR119 (0.52) GPR119HRH3TRPV6CHRNB2CHRNA4
SCHEMBL19302597 0.76 GPR119 (0.52) GPR119HRH3TRPV6CHRNB2CHRNA4
SCHEMBL5798534 0.74 NOTUM (0.59) GPR119HRH3CHRNB2CHRNA4CHRNB4
SCHEMBL8307614 0.74 GPR119 (0.47) GPR119NPY5RHRH3CHRNB2CHRNA4
SCHEMBL27600357 0.73 CHRNB2 (0.51) GPR119HRH3TRPV6CHRNB2CHRNA4
SCHEMBL12988214 0.73 CHRNB2 (0.51) GPR119HRH3TRPV6CHRNB2CHRNA4
SCHEMBL31401347 0.73 KDM4E (0.61) GPR119NPY5RHRH3TRPV6CHRNB2
SCHEMBL30664035 0.73 KDM4E (0.61) GPR119NPY5RHRH3TRPV6CHRNB2
SCHEMBL6502064 0.72 GPR119 (0.50) GPR119NPY5RNPC1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3861000-A1 THIENO[3,2-B]PYRIDINE DERIVATIVES AS UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE Genzyme Corporation (US) 2021-08-11 EP disclosed
WO-2020072504-A1 THIENO[3,2-B]PYRIDINE DERIVATIVES AS UDP GLYCOSYLTRANSFERASE INHIBITORS AND METHODS OF USE GENZYME CORPORATION (US) 2020-04-09 WO disclosed