SCHEMBL25290263

SCHEMBL25290263

CC(C)(C)N(Cc1ccc(F)cc1CC=C=O)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 6/20 0.37
GRM5 P41594 2/20 0.34
SLC6A2 P23975 5/20 0.32
SLC6A4 P31645 5/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
HTT P42858 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
DPP4 P27487 2/20 0.31
DPP9 Q86TI2 2/20 0.31
DPP7 Q9UHL4 2/20 0.31
DPP8 Q6V1X1 1/20 0.31
SNCA P37840 1/20 0.30
SLC6A3 Q01959 1/20 0.30

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
SCHEMBL25242302 0.86 RIPK1 (0.39) RIPK1GRM5SLC6A2SLC6A4MEN1
SCHEMBL5651229 0.81 RIPK1 (0.42) RIPK1GRM5SLC6A2SLC6A4MEN1
SCHEMBL5647255 0.80 RIPK1 (0.41) RIPK1GRM5SLC6A2SLC6A4MEN1
SCHEMBL25286605 0.79 RIPK1 (0.34) RIPK1GRM5SLC6A2SLC6A4
SCHEMBL25242324 0.78 RIPK1 (0.37) RIPK1GRM5SLC6A2SLC6A4MEN1
SCHEMBL25286462 0.77 RIPK1 (0.36) RIPK1GRM5SLC6A2SLC6A4MEN1
SCHEMBL5648402 0.76 RIPK1 (0.38) RIPK1GRM5SLC6A2SLC6A4MEN1
SCHEMBL3754160 0.75 KCNA5 (0.41) RIPK1LMNAALDH1A1
SCHEMBL1438626 0.68 RIPK1 (0.41) RIPK1MEN1KMT2AHTTL3MBTL1
SCHEMBL2518672 0.67 MEN1 (0.38) RIPK1MEN1KMT2AHTTL3MBTL1

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-2023125935-A1 BENZOPYRIDINE DERIVATIVE REGULATOR, AND PREPARATION METHOD THEREFOR AND USE THEREOF 上海翰森生物医药科技有限公司 2023-07-06 WO disclosed