SCHEMBL7748341

SCHEMBL7748341

CO[SiH](Cc1ccc(N(C)C)cc1)OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
TSHR P16473 4/20 0.52
MAPK1 P28482 3/20 0.52
CYP3A4 P08684 2/20 0.52
TDP1 Q9NUW8 2/20 0.52
HSD17B10 Q99714 2/20 0.46
ALOX15 P16050 2/20 0.46
CALM1 P0DP23 2/20 0.46
APP P05067 3/20 0.41
HPGD P15428 2/20 0.40
KDM4E B2RXH2 1/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TP53 P04637 1/20 0.38
SLC2A1 P11166 1/20 0.37
HDAC1 Q13547 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
MAPT P10636 1/20 0.36
HRH3 Q9Y5N1 2/20 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
SCHEMBL3692713 0.79
SCHEMBL9412745 0.76 ALDH1A1 (0.41) ALDH1A1TSHRMAPK1TDP1SMN1; SMN2
SCHEMBL384789 0.76 AGXT (0.43) TDP1TP53MAPTHRH3
SCHEMBL963476 0.74 CA1 (0.34)
SCHEMBL483523 0.74 TDP1 (0.44) ALDH1A1TSHRMAPK1CYP3A4TDP1
SCHEMBL6890461 0.74 ESR1 (0.44) ALDH1A1CYP3A4HSD17B10CALM1KDM4E
SCHEMBL17937673 0.74 IDO1 (0.41) ALDH1A1APPKDM4ENPC1GAA
SCHEMBL17937819 0.74 IDO1 (0.41) ALDH1A1APP
SCHEMBL27999991 0.74 IDO1 (0.52) ALDH1A1TSHRCYP3A4ALOX15CALM1
SCHEMBL49102 0.73 TP53 (0.42) ALDH1A1TSHRCYP3A4TDP1CALM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0727443-B1 Catalyst for olefin polymerization and process for producing olefin polymers TOSOH CORP (JP) 2001-01-17 EP disclosed
US-5807938-A Catalyst for olefin polymerization and process for producing olefin polymers TOSOH CORPORATION (JP) 1998-09-15 US disclosed
EP-0727443-A1 Catalyst for olefin polymerization and process for producing olefin polymers Tosoh Corporation (JP) 1996-08-21 EP disclosed