SCHEMBL31455326

SCHEMBL31455326

CCN(Cc1ccc(N)c(F)c1)[C@H]1CC[C@@H](C(=O)OC)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.37
DPP8 Q6V1X1 1/20 0.37
DPP9 Q86TI2 1/20 0.37
DPP7 Q9UHL4 1/20 0.37
ALDH1A1 P00352 6/20 0.37
HSD11B1 P28845 1/20 0.36
KDM4E B2RXH2 5/20 0.36
HTT P42858 2/20 0.36
MITF O75030 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
GRIN2B Q13224 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
KCNQ2 O43526 1/20 0.34
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
RAB9A P51151 1/20 0.33
ACKR3 P25106 1/20 0.33
LGMN Q99538 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL31455570 1.00 DPP4 (0.37) DPP4DPP8DPP9DPP7ALDH1A1
SCHEMBL31455549 0.86 ALDH1A1 (0.36) DPP4DPP9DPP7ALDH1A1HSD11B1
SCHEMBL31455336 0.86 ALDH1A1 (0.36) DPP4DPP9DPP7ALDH1A1HSD11B1
SCHEMBL31455524 0.83 ALDH1A1 (0.39) DPP4DPP8DPP9DPP7ALDH1A1
SCHEMBL31455310 0.83 MAPT (0.42) DPP4DPP8DPP9DPP7ALDH1A1
SCHEMBL31455436 0.83 MAPT (0.42) DPP4DPP8DPP9DPP7ALDH1A1
SCHEMBL31455368 0.83 MAPT (0.42) DPP4DPP8DPP9DPP7ALDH1A1
SCHEMBL28972001 0.77 MEN1 (0.42) ALDH1A1HTTMEN1KMT2ASMN1; SMN2
SCHEMBL31455034 0.74 ALDH1A1 (0.39) ALDH1A1HSD11B1KDM4EHTTMEN1
SCHEMBL31455403 0.73 TAS2R14 (0.39) DPP4DPP9DPP7MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025059577-A1 SUBSTITUTED AMINOPYRIDINE COMPOUNDS FOR USE AS AKT1 INHIBITORS ATAVISTIK BIO, INC. (US) 2025-03-20 WO disclosed