SCHEMBL7362134

SCHEMBL7362134

CCCC[Si](C)(C)Oc1ccc(Br)c2ccc(C)nc12

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.32
LMNA P02545 2/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HTT P42858 1/20 0.32
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL28065706 0.78 KDM4E (0.43) KDM4ELMNAHTTMEN1KMT2A
SCHEMBL3463767 0.76 CCR1 (0.33) KDM4ELMNAMAPTHTTMEN1
SCHEMBL681786 0.74 NQO2 (0.50) ALDH1A1MAPTNPSR1MEN1KMT2A
SCHEMBL6585052 0.69 MEN1 (0.40) KDM4ELMNAALDH1A1MAPTHTT
SCHEMBL4701309 0.69 MBOAT4 (0.36) KDM4ELMNAMAPTHTTMEN1
Tetrabuthylammonium SCHEMBL7369591 0.68 KMT2A (0.48) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL6755221 0.68 HPGD (0.34) KDM4ELMNAALDH1A1MAPTMEN1
SCHEMBL6509825 0.67 LMNA (0.40) LMNAMAPT
SCHEMBL17506427 0.66 KMT2A (0.50) KDM4ELMNAALDH1A1MAPTHTT
SCHEMBL1421106 0.66 SLC6A4 (0.37) KDM4ELMNAALDH1A1MAPTNPSR1

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
EP-0952832-A1 QUINOLINE CARBOXAMIDES AS TNF INHIBITORS AND AS PDE-IV INHIBITORS Darwin Discovery Limited (GB) 1999-11-03 EP disclosed
WO-1997044036-A1 QUINOLINE CARBOXAMIDES AS TNF INHIBITORS AND AS PDE-IV INHIBITORS DARWIN DISCOVERY LIMITED (GB) 1997-11-27 WO disclosed