SCHEMBL3908799

SCHEMBL3908799

COCCOCCO[Si](CCOC(=O)c1ccncc1)(OCCOCCOC)OCCOCCOC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
ABCB11 O95342 1/20 0.44
CYP3A4 P08684 1/20 0.44
ADRA2B P18089 1/20 0.44
OPRD1 P41143 1/20 0.44
SCN5A Q14524 1/20 0.44
MAPT P10636 1/20 0.44
KDM4E B2RXH2 3/20 0.43
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.40
TSHR P16473 3/20 0.40
GLA P06280 1/20 0.40
RAB9A P51151 1/20 0.40
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39

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
SCHEMBL3914955 0.92 CYP3A4 (0.45) KMT2AABCB11CYP3A4ADRA2BOPRD1
SCHEMBL3910178 0.88 KDM4E (0.43) KMT2AABCB11CYP3A4ADRA2BOPRD1
SCHEMBL14919008 0.82 TSHR (0.55) KMT2AABCB11CYP3A4ADRA2BOPRD1
SCHEMBL3914292 0.82 CYP19A1 (0.52) LMNASMN1; SMN2ALDH1A1
SCHEMBL3918051 0.81 L3MBTL1 (0.45) KMT2ACYP3A4MAPTKDM4ELMNA
SCHEMBL17641405 0.79 KDM4E (0.57) KMT2AMAPTKDM4ELMNAL3MBTL1
SCHEMBL3912012 0.78 APP (0.47) KMT2AMAPTKDM4EL3MBTL1TSHR
SCHEMBL9928660 0.76 CYP3A4 (0.66) ABCB11CYP3A4ADRA2BOPRD1SCN5A
SCHEMBL3916941 0.74 CYP19A1 (0.50) LMNAL3MBTL1TSHRSMN1; SMN2ALDH1A1
SCHEMBL4350526 0.74 KMT2A (0.47) KMT2AMAPTKDM4ELMNAL3MBTL1

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
US-20090277559-A1 METHOD FOR VULCANIZATION-ADHERING RUBBER COMPOSITION TO ADHERENT OF BRASS OR PLATED WITH BRASS, REINFORCING MEMBER FOR RUBBER ARTICLE, RUBBER-REINFORCING MEMBER COMPOSITE AND PNEUMATIC TIRE BRIDGESTONE CORPORATION (JP) 2009-11-12 US disclosed
EP-1840158-B1 METHOD FOR VULCANIZATION AND ADHESION OF RUBBER COMPOSITION WITH ARTICLE TO BE ADHERED BEING MADE OF BRASS OR PLATED WITH BRASS, REINFORCING MATERIAL FOR RUBBER ARTICLE, RUBBER-REINFORCING MATERIAL COMPOSITE, AND PNEUMATIC TIRE BRIDGESTONE CORP (JP) 2009-02-18 EP disclosed