SCHEMBL26985409

SCHEMBL26985409

Cc1c(Cc2ccnc(N(C(=O)O)C(=O)OC(C)(C)C)c2F)cccc1Nc1ccc(Cl)cc1F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR52 Q9Y2T5 2/20 0.40
NUDT1 P36639 4/20 0.36
MEN1 O00255 2/20 0.35
MAPT P10636 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
MKNK1 Q9BUB5 1/20 0.35
KDR P35968 3/20 0.33
S1PR3 Q99500 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
FLT1 P17948 2/20 0.33
FGFR1 P11362 1/20 0.33
NR3C1 P04150 1/20 0.32
PGR P06401 1/20 0.32
NR3C2 P08235 1/20 0.32
AR P10275 1/20 0.32
FPR1 P21462 1/20 0.32

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
SCHEMBL31686074 0.96 GPR52 (0.41) GPR52NUDT1MEN1MAPTKMT2A
SCHEMBL26985070 0.86 NUDT1 (0.40) GPR52NUDT1MEN1MAPTKMT2A
SCHEMBL26985124 0.82 SYK (0.34) NUDT1S1PR3TGFBR1
SCHEMBL26984842 0.81 NUDT1 (0.38) NUDT1MEN1MAPTKMT2AMKNK1
SCHEMBL26984982 0.81 FPR2 (0.36) KDR
SCHEMBL30746582 0.80 DHODH (0.38) GPR52KDR
SCHEMBL26985057 0.80 DHODH (0.38) GPR52KDR
SCHEMBL26985281 0.79 SSTR4 (0.35)
SCHEMBL30746490 0.78 NUDT1 (0.38) GPR52NUDT1MEN1MAPTKMT2A
SCHEMBL30746628 0.78 NUDT1 (0.38) GPR52NUDT1MEN1MAPTKMT2A

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-2024010925-A2 MITOGEN-ACTIVATED PROTEIN KINASE (MEK) INHIBITORS NESTED THERAPEUTICS, INC. (US) 2024-01-11 WO disclosed