SCHEMBL13086993

SCHEMBL13086993

CCO[Si](CCCSCc1cccn(CC(=O)OC)c1=O)(N=O)OCC

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
P2RX3 P56373 1/20 0.32
KMT2A Q03164 3/20 0.31
ALDH1A1 P00352 3/20 0.31
MEN1 O00255 2/20 0.31
RAB9A P51151 1/20 0.31
ADORA2A P29274 1/20 0.31
NPC1 O15118 1/20 0.30
HSD17B10 Q99714 1/20 0.30
KDM1A O60341 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
SCHEMBL9611244 0.88 NPC1 (0.34) KDM4ESMN1; SMN2P2RX3KMT2AALDH1A1
SCHEMBL16382488 0.76 KDM4E (0.37) KDM4ESMN1; SMN2P2RX3KMT2AALDH1A1
SCHEMBL9611242 0.69 GRM2 (0.34) KDM4EALDH1A1RAB9ANPC1HSD17B10
SCHEMBL9611240 0.68 PDE10A (0.33) KDM4EKMT2AALDH1A1MEN1RAB9A
SCHEMBL9611243 0.67 ALDH1A1 (0.34) KDM4ESMN1; SMN2KMT2AALDH1A1NPC1
SCHEMBL8102665 0.63 KDM4E (0.50) KDM4ESMN1; SMN2ALDH1A1
SCHEMBL9609770 0.63 KDM4E (0.50) KDM4ESMN1; SMN2KMT2AALDH1A1
SCHEMBL22114505 0.62 KDM4E (0.49) KDM4ESMN1; SMN2KMT2AALDH1A1HSD17B10
SCHEMBL29255151 0.62 KDM4E (0.49) KDM4ESMN1; SMN2KMT2AALDH1A1HSD17B10
SCHEMBL8649103 0.62 ELANE (0.51) KDM4ESMN1; SMN2KMT2AALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010118180-A1 FABRICS COMPRISING A PHOTOCATALYST TO PRODUCE SINGLET OXYGEN FROM AMBIENT OXYGEN LOMBARDI JOHN L (US) 2010-10-14 WO disclosed