SCHEMBL4449826

SCHEMBL4449826

CCO[SiH](C)C.CNC1CCCCC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
ALDH1A1 P00352 4/20 0.32
HSD17B10 Q99714 1/20 0.32
SIGMAR1 Q99720 2/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SHBG P04278 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MEN1 O00255 1/20 0.31
NPC1 O15118 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
EPHX1 P07099 1/20 0.31
KDM4E B2RXH2 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
SCHEMBL1516288 0.88 THRB (0.34) THRBATML3MBTL1MMP1MMP2
SCHEMBL141766 0.86 THRB (0.35) THRBATML3MBTL1MMP1MMP2
SCHEMBL20985091 0.83 THRB (0.33) THRBATML3MBTL1MMP1MMP2
SCHEMBL21874986 0.82 THRB (0.33) THRBATML3MBTL1MMP1MMP2
Ether SCHEMBL28087840 0.79 THRB (0.38) THRBATML3MBTL1MMP1MMP2
SCHEMBL1485899 0.75 ALDH1A1 (0.53) ALDH1A1HSD17B10SIGMAR1NPC1MAPT
SCHEMBL3036481 0.75 ALDH1A1 (0.53) ALDH1A1HSD17B10SIGMAR1NPC1MAPT
SCHEMBL1148684 0.75
SCHEMBL3035987 0.75 ALDH1A1 (0.53) ALDH1A1HSD17B10SIGMAR1NPC1MAPT
SCHEMBL13166298 0.75 ALDH1A1 (0.53) ALDH1A1HSD17B10SIGMAR1NPC1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1624027-B2 CURING COMPOSITION KANEKA CORP (JP) 2018-04-18 EP disclosed
EP-1624027-B1 CURING COMPOSITION KANEKA CORP (JP) 2014-08-27 EP disclosed
US-7605220-B2 Curing composition KANEKA CORPORATION (JP) 2009-10-20 US disclosed
US-20060252903-A1 Curing composition KANEKA CORPORATION 2006-11-09 US disclosed
EP-1624027-A1 CURING COMPOSITION KANEKA CORPORATION (JP) 2006-02-08 EP disclosed