SCHEMBL7259386

SCHEMBL7259386

C[C@H](O[Si](C)(C)C(C)(C)C)[C@H](CCOc1cccc(-c2csc(-c3ccccc3)n2)c1)c1nc(C(N)=O)c[nH]1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.39
SMN1; SMN2 Q16637 5/20 0.39
HTT P42858 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
TP53 P04637 1/20 0.39
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 1/20 0.37
PLAU P00749 1/20 0.36
ATP4A P20648 5/20 0.35
ATP4B P51164 5/20 0.35
LMNA P02545 1/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
EIF4E P06730 2/20 0.34
AKT1 P31749 1/20 0.34
CYP19A1 P11511 1/20 0.34

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
SCHEMBL7263113 0.92 ATP4A (0.35) MAPTSMN1; SMN2HTTKDM4EMEN1
SCHEMBL7259393 0.87 PSMB5 (0.33) SMN1; SMN2MEN1KMT2ATP53MAPK1
SCHEMBL7262972 0.85 HSD17B1 (0.33)
SCHEMBL7258931 0.83 HSD17B1 (0.32)
SCHEMBL7264023 0.82 FFAR1 (0.35) HTTKDM4EALDH1A1LMNA
SCHEMBL5673933 0.82 ADA (0.50) MAPTSMN1; SMN2HTTKDM4EMEN1
SCHEMBL7264650 0.82 DHODH (0.34) MAPTSMN1; SMN2HTTKDM4EMEN1
SCHEMBL7259445 0.82 MAPT (0.40) MAPTSMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL7264341 0.82 CHEK2 (0.35) MAPTSMN1; SMN2NPC1RAB9A
SCHEMBL7264346 0.80 ATP4A (0.38) MAPTSMN1; SMN2HTTKDM4EMEN1

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
WO-2003006437-A1 IMIDAZOLE DERIVATIVES AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-01-23 WO claimed
WO-2003006437-A1 IMIDAZOLE DERIVATIVES AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-01-23 WO disclosed