SCHEMBL6537064

SCHEMBL6537064

CCO[Si](CCCC(C)NC(=O)O)(OCC)OCC

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.38
TAS1R1 Q7RTX1 2/20 0.38
TAS1R2 Q8TE23 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.35
CYP2C19 P33261 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2D6 P10635 1/20 0.31
HRH3 Q9Y5N1 3/20 0.30
POLB P06746 2/20 0.30
HRH4 Q9H3N8 2/20 0.30
KMT2A Q03164 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
SCHEMBL5916537 0.83 TAS1R3 (0.36) TAS1R3TAS1R1TAS1R2SMN1; SMN2CYP2C19
SCHEMBL7089238 0.83
SCHEMBL8326130 0.83
SCHEMBL4355761 0.80 CAD (0.33) TAS1R3TAS1R1TAS1R2HRH3HRH4
SCHEMBL8180510 0.78 KMT2A (0.33) POLBKMT2A
SCHEMBL29066700 0.77 BLM (0.44) CYP1A2
SCHEMBL8464768 0.77 MEN1 (0.43) KMT2A
SCHEMBL8465369 0.77 MEN1 (0.32) KMT2A
SCHEMBL8959221 0.77 TDP1 (0.33) KMT2A
SCHEMBL21930790 0.75 TAS1R3 (0.42) TAS1R3TAS1R1TAS1R2SMN1; SMN2CYP2C19

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
US-6673954-B1 REACTING AN AMINOORGANOSILANE WITH AN ORGANOCARBONATE ESTER, BASIC CATALYST GENERAL ELECTRIC COMPANY 2004-01-06 US disclosed