SCHEMBL7449607

SCHEMBL7449607

CC(C[C@H](O[Si](C)(C)C(C)(C)C)c1ccccc1)c1nc(C(=O)O)c[nH]1

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.31
NPSR1 Q6W5P4 3/20 0.31
MAPK1 P28482 2/20 0.31
RECQL P46063 2/20 0.31
POLB P06746 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL7839017 0.90 MAPT (0.34) MAPTNPSR1MAPK1RECQLPOLB
SCHEMBL7452899 0.83 CA2 (0.30)
SCHEMBL7456315 0.77 SLC7A5 (0.35) MEN1KMT2A
SCHEMBL7446159 0.73 RIPK1 (0.37)
SCHEMBL7452060 0.70 MBTD1 (0.33) MAPTNPSR1MAPK1RECQLPOLB
SCHEMBL7453038 0.69 BCAT2 (0.42)
SCHEMBL6525612 0.69 ATM (0.39) MAPTALDH1A1MEN1KMT2A
SCHEMBL13871075 0.69 RIPK1 (0.39) POLB
SCHEMBL7449602 0.69 ADRB2 (0.34) POLB
SCHEMBL8789100 0.69 CA2 (0.41) MAPTMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1098885-A1 IMIDAZOLE COMPOUNDS AND THEIR USE AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-05-16 EP disclosed
WO-2001026605-A2 IMMUNOSUPPRESSIVE COMPOSITION CONTAINING IL-2 INHIBITOR AND AN ADENOSINE DEAMINASE INHIBITOR FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-04-19 WO disclosed
WO-2000005217-A1 IMIDAZOLE COMPOUNDS AND THEIR USE AS ADENOSINE DEAMINASE INHIBITORS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-02-03 WO disclosed