SCHEMBL6973521

SCHEMBL6973521

Cn1c(CO[Si](C)(C)C(C)(C)C)nc(CO)c1Sc1cccc(Cl)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAOB P27338 4/20 0.33
MAOA P21397 1/20 0.33
GRM5 P41594 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 1/20 0.32
EGFR P00533 1/20 0.31
LCK P06239 1/20 0.31
DHFR P00374 2/20 0.31
PPP1CA P62136 1/20 0.31
PTPN11 Q06124 1/20 0.31
ALOX12 P18054 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
SCHEMBL6967547 0.91 MEN1 (0.35) KMT2AMEN1NPSR1TDP1L3MBTL1
SCHEMBL8343051 0.89 LMNA (0.34) KMT2AMEN1NPSR1TDP1L3MBTL1
SCHEMBL6966584 0.88 MEN1 (0.37) KMT2AMEN1NPSR1TDP1L3MBTL1
SCHEMBL6972414 0.87 MEN1 (0.39) KMT2AMEN1NPSR1TDP1L3MBTL1
SCHEMBL8800399 0.86 MEN1 (0.36) KMT2AMEN1NPSR1TDP1L3MBTL1
SCHEMBL8800395 0.85 KMT2A (0.35) KMT2AMEN1NPSR1TDP1L3MBTL1
SCHEMBL8343056 0.82 MEN1 (0.35) KMT2AMEN1NPSR1TDP1L3MBTL1
SCHEMBL6962750 0.81 MEN1 (0.39) KMT2AMEN1NPSR1TDP1L3MBTL1
SCHEMBL6960398 0.80 MEN1 (0.38) KMT2AMEN1NPSR1TDP1L3MBTL1
SCHEMBL6969170 0.77 MEN1 (0.41) KMT2AMEN1NPSR1TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0786455-B1 IMIDAZOLE DERIVATIVE SHIONOGI & CO (JP) 2003-12-03 EP disclosed
US-6147097-A METHOD FOR TREATING AIDS SHIONOGI & CO., LTD. (JP) 2000-11-14 US disclosed
US-5910506-A IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC SHIONOGI & CO., LTD. (JP) 1999-06-08 US disclosed
EP-0786455-A1 IMIDAZOLE DERIVATIVE SHIONOGI & CO., LTD. (JP) 1997-07-30 EP disclosed