SCHEMBL17281183

SCHEMBL17281183

CCCSCCSCCO

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.62
ROCK2 O75116 1/20 0.37
ALDH1A1 P00352 3/20 0.35
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NOS3 P29474 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32
LMNA P02545 2/20 0.32
HSD17B10 Q99714 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TSHR P16473 1/20 0.32
ICMT O60725 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
SCHEMBL178530 0.97
Thiodiglycol SCHEMBL9622061 0.87 TDP1 (0.71) TDP1ROCK2ALDH1A1HPGDSMN1; SMN2
SCHEMBL12073719 0.86 TDP1 (0.53) TDP1ROCK2ALDH1A1SMN1; SMN2LMNA
Alcohol SCHEMBL28630890 0.83 ALDH1A1 (0.46) TDP1ALDH1A1HPGDSMN1; SMN2NOS3
SCHEMBL195715 0.83 TDP1 (0.91) TDP1ROCK2SMN1; SMN2LMNAHSD17B10
SCHEMBL9638413 0.83 TDP1 (0.91) TDP1ROCK2SMN1; SMN2LMNAHSD17B10
SCHEMBL3900037 0.83 TDP1 (0.91) TDP1ROCK2SMN1; SMN2LMNAHSD17B10
SCHEMBL10122625 0.83 TDP1 (0.40) TDP1ALDH1A1HPGDNOS3NOS1
SCHEMBL12570288 0.83 TDP1 (0.40) TDP1ALDH1A1HPGDNOS3NOS1
SCHEMBL10122628 0.83 TDP1 (0.40) TDP1ALDH1A1HPGDNOS3NOS1

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-20150340246-A1 METHOD OF FORMING PATTERNS AND METHOD OF MANUFACTURING INTEGRATED CIRCUIT DEVICE USING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-11-26 US disclosed