SCHEMBL4544298

SCHEMBL4544298

CCO[Si](OCC)(OCC)C(C)CCNC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
CASR P41180 1/20 0.33
CTSL P07711 2/20 0.32
LMNA P02545 1/20 0.32
CAPN1 P07384 1/20 0.32
CTSB P07858 1/20 0.32
CTSG P08311 1/20 0.32
CHRNB2 P17787 2/20 0.32
CHRNB4 P30926 2/20 0.32
CHRNA4 P43681 2/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CHRNA3 P32297 1/20 0.32
EGLN1 Q9GZT9 1/20 0.31
GAA P10253 2/20 0.30
MGAM O43451 1/20 0.30
SI P14410 1/20 0.30
MGAM2 Q2M2H8 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
SCHEMBL3476847 0.86 EPHX1 (0.43) LMNACHRNB2CHRNB4CHRNA4CHRNA3
SCHEMBL3144816 0.84 CHRNB2 (0.31) CHRNB2CHRNB4CHRNA4CHRNA3
SCHEMBL4540745 0.81 CYP2D6 (0.39) CYP2D6CYP2C19CASRLMNACHRNB2
SCHEMBL2261531 0.77
SCHEMBL29270372 0.76 GABRP (0.48)
SCHEMBL733568 0.74 TSHR (0.31)
SCHEMBL3910038 0.73 GABRP (0.31)
SCHEMBL3464049 0.73 CYP2C19 (0.32) CYP2C19MEN1KMT2A
SCHEMBL22495750 0.72
SCHEMBL3155313 0.71 CHRNB2 (0.36) CHRNB2CHRNB4CHRNA4CHRNA3

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
EP-1937697-B1 METHOD FOR PRODUCTION OF ISOCYANATOSILANES MOMENTIVE PERFORMANCE MAT INC (US) 2013-10-16 EP claimed
EP-1869058-B1 PROCESS FOR MAKING SILYLISOCYANURATE MOMENTIVE PERFORMANCE MAT INC (US) 2009-12-16 EP claimed