SCHEMBL5855494

SCHEMBL5855494

C[SiH](C)[Zr](Cl)(Cl)(NC(=O)c1cccc(C(C)(C)C)c1)C1C=Cc2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 4/20 0.38
HDAC6 Q9UBN7 2/20 0.38
NR1H4 Q96RI1 1/20 0.36
ACHE P22303 3/20 0.36
NPSR1 Q6W5P4 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
BRAF P15056 1/20 0.32
CTSL P07711 1/20 0.32
HDAC3 O15379 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
TAS1R2 Q8TE23 1/20 0.31
LMNA P02545 2/20 0.31
GAA P10253 1/20 0.31
KCNK3 O14649 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
SCHEMBL5854082 0.89 NR1H4 (0.36) HDAC8HDAC6NR1H4ACHEKCNK9
SCHEMBL5854537 0.86 SMN1; SMN2 (0.41) HDAC8HDAC6NPSR1KCNK9MEN1
SCHEMBL5854609 0.86 MEN1 (0.33) HDAC8HDAC6MEN1KMT2ASMN1; SMN2
SCHEMBL5853098 0.82 POLB (0.33) MEN1KMT2ASMN1; SMN2TAS1R3TAS1R1
SCHEMBL5855776 0.80 ITGB1 (0.30)
SCHEMBL5853338 0.79 ALDH1A1 (0.33) GAA
SCHEMBL5854517 0.78 TAS1R3 (0.38) TAS1R3TAS1R1TAS1R2
SCHEMBL5854772 0.78 BRD4 (0.30)
SCHEMBL5854108 0.77 TAS1R3 (0.34) MEN1KMT2ATAS1R3TAS1R1TAS1R2
SCHEMBL5852517 0.76 NPC1 (0.38) SMN1; SMN2

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
US-7037989-B2 Copolymers of ethylene and/or α-olefins and vicinally disubstituted olefins EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-05-02 US disclosed
WO-2004106394-A1 COPOLYMERS OF ETHYLENE AND/OR α-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-12-09 WO disclosed
US-20040242814-A1 COPOLYMERS OF ETHYLENE AND/OR ALPHA-OLEFINS AND VICINALLY DISUBSTITUTED OLEFINS EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-02 US disclosed