SCHEMBL6607902

SCHEMBL6607902

CCCC[Si](C)(C)C#CCOC1CCCCO1

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KDM4C Q9H3R0 1/20 0.31
GRM5 P41594 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL6534796 0.82 GRM5 (0.32) KDM4CGRM5NPC1RAB9A
SCHEMBL1004656 0.82 KDM4C (0.36) MEN1KMT2AKDM4CGRM5NPC1
SCHEMBL7881560 0.78 MEN1 (0.33) MEN1KMT2AKDM4CGRM5ALDH1A1
SCHEMBL6535768 0.78 KDM4C (0.31) KDM4CGRM5NPC1RAB9A
SCHEMBL23014903 0.77 MEN1 (0.35) MEN1KMT2AALDH1A1TDP1
SCHEMBL23014928 0.77 MEN1 (0.35) MEN1KMT2AALDH1A1TDP1
SCHEMBL23014986 0.77 MEN1 (0.35) MEN1KMT2AALDH1A1TDP1
SCHEMBL10814170 0.77 MEN1 (0.35) MEN1KMT2AALDH1A1TDP1
SCHEMBL2478287 0.77 MEN1 (0.35) MEN1KMT2AALDH1A1TDP1
SCHEMBL23015059 0.77 MEN1 (0.35) MEN1KMT2AALDH1A1TDP1

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-1379522-A1 DIHYDRO-BENZO(b)(1,4)DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS I F. HOFFMANN-LA ROCHE AG (CH) 2004-01-14 EP disclosed
EP-1379511-A1 DIHYDRO-BENZO (b) (1, 4) DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II F. HOFFMANN-LA ROCHE AG (CH) 2004-01-14 EP disclosed
WO-2002083652-A1 DIHYDRO-BENZO [b] [1, 4] DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS II F. HOFFMANN-LA ROCHE AG (CH) 2002-10-24 WO disclosed
WO-2002083665-A1 DIHYDRO-BENZO[b][1,4]DIAZEPIN-2-ONE DERIVATIVES AS MGLUR2 ANTAGONISTS I F. HOFFMANN-LA ROCHE AG (CH) 2002-10-24 WO disclosed