SCHEMBL9079378

SCHEMBL9079378

C[Si](C)Oc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
HSD17B10 Q99714 6/20 0.54
L3MBTL1 Q9Y468 4/20 0.54
TDP1 Q9NUW8 4/20 0.54
ALOX12 P18054 4/20 0.54
MAPK1 P28482 3/20 0.54
TSHR P16473 3/20 0.54
ALOX15 P16050 2/20 0.54
PTGS1 P23219 1/20 0.54
SLC6A2 P23975 1/20 0.54
PTGS2 P35354 1/20 0.54
HTR2B P41595 1/20 0.54
MAPT P10636 8/20 0.52
GAA P10253 5/20 0.52
HSP90AA1 P07900 1/20 0.52
HPGD P15428 2/20 0.50
THRB P10828 2/20 0.46
RECQL P46063 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46

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
SCHEMBL276553 0.79 CA4 (0.48) TSHRLMNAHTTSMN1; SMN2
SCHEMBL316390 0.76 RAB9A (0.81) ALDH1A1HSD17B10L3MBTL1TDP1ALOX12
SCHEMBL9479393 0.76 RAB9A (0.81) ALDH1A1HSD17B10L3MBTL1TDP1ALOX12
SCHEMBL8626416 0.75 ALDH1A1 (0.68) ALDH1A1HSD17B10L3MBTL1TDP1ALOX12
SCHEMBL13308524 0.75 ALDH1A1 (0.68) ALDH1A1HSD17B10L3MBTL1TDP1ALOX12
Hydrochloric Acid SCHEMBL7128947 0.74 RAB9A (0.77) ALDH1A1HSD17B10L3MBTL1TDP1ALOX12
SCHEMBL9480038 0.74 ALDH1A1 (1.00) ALDH1A1HSD17B10L3MBTL1TDP1ALOX12
SCHEMBL13663470 0.74 ALDH1A1 (1.00) ALDH1A1HSD17B10L3MBTL1TDP1ALOX12
SCHEMBL7896372 0.74 ALDH1A1 (1.00) ALDH1A1HSD17B10L3MBTL1TDP1ALOX12
N,N'-Diphenyl-P-Phenylenediamine SCHEMBL42930 0.74 ALDH1A1 (1.00) ALDH1A1HSD17B10L3MBTL1TDP1ALOX12

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
JP-8143883-A None JP disclosed
JP-H08143883-A HEAT-RESISTANT GREASE COMPOSITION DOW CORNING ASIA LTD 1996-06-04 JP disclosed