SCHEMBL7773373

SCHEMBL7773373

C[Si](CC(N)=O)(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.46
ALOX5 P09917 3/20 0.40
CYP2C19 P33261 3/20 0.38
HSD17B10 Q99714 2/20 0.38
POLB P06746 1/20 0.38
CYP3A4 P08684 1/20 0.38
PARP1 P09874 1/20 0.38
TSHR P16473 1/20 0.38
RECQL P46063 1/20 0.38
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
PKM P14618 1/20 0.36

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
SCHEMBL5364559 0.71 MAPT (0.42) MAPTALOX5CYP2C19HSD17B10POLB
SCHEMBL5481190 0.71 MAPT (0.46) MAPTCYP2C19HSD17B10POLBCYP3A4
SCHEMBL7935088 0.70 ESR1 (0.44) MAPTTSHRTDP1ESR1ESR2
SCHEMBL9339400 0.70 ESR1 (0.39) MAPTESR1ESR2SMN1; SMN2
SCHEMBL17654196 0.70 MAPT (0.48) MAPTCYP2C19HSD17B10CYP3A4RECQL
SCHEMBL30352387 0.70 MAPT (0.63) MAPTCYP2C19HSD17B10CYP3A4RECQL
SCHEMBL5481180 0.69 CYP2C19 (0.42) MAPTALOX5CYP2C19SMN1; SMN2CYP1A2
SCHEMBL6914194 0.69 ALDH1A1 (0.48) MAPTPOLBRECQLL3MBTL1ESR1
SCHEMBL9225762 0.69 ESR1 (0.42) MAPTTSHRESR1ESR2SMN1; SMN2
SCHEMBL1270651 0.69 ESR1 (0.42) MAPTTSHRESR1ESR2SMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1114065-A1 CELLULOSE MICROFIBRILS WITH MODIFIED SURFACE, PREPARATION METHOD AND USE THEREOF RHODIA CHIMIE (FR) 2001-07-11 EP claimed
WO-2000015667-A1 CELLULOSE MICROFIBRILS WITH MODIFIED SURFACE, PREPARATION METHOD AND USE THEREOF RHODIA CHIMIE (FR) 2000-03-23 WO claimed
EP-1114065-A1 CELLULOSE MICROFIBRILS WITH MODIFIED SURFACE, PREPARATION METHOD AND USE THEREOF RHODIA CHIMIE (FR) 2001-07-11 EP disclosed
WO-2000015667-A1 CELLULOSE MICROFIBRILS WITH MODIFIED SURFACE, PREPARATION METHOD AND USE THEREOF RHODIA CHIMIE (FR) 2000-03-23 WO disclosed