SCHEMBL8765966

SCHEMBL8765966

C=CC(=O)NCCC(F)(F)F

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
TSHR P16473 2/20 0.50
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
ZDHHC20 Q5W0Z9 1/20 0.47
ZDHHC2 Q9UIJ5 1/20 0.47
GAA P10253 1/20 0.37
TGM2 P21980 8/20 0.35
POLB P06746 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CFTR P13569 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
JAK3 P52333 1/20 0.31
MAPT P10636 1/20 0.30
MTNR1A P48039 1/20 0.30
MTNR1B P49286 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
SCHEMBL8766172 0.83 ZDHHC20 (0.48) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL2151789 0.80 TSHR (0.52) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL12200555 0.79 ALDH1A1 (0.42) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL6283366 0.78 ZDHHC20 (0.52) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL10952688 0.78 TSHR (0.68) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL167051 0.78 TSHR (0.68) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL12200552 0.77 ALDH1A1 (0.41) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL1695817 0.77 TSHR (0.54) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL12731248 0.77 ZDHHC20 (0.50) ALDH1A1TSHRMAPK1TDP1ZDHHC20
SCHEMBL27233663 0.77 ALDH1A1 (0.48) ALDH1A1TSHRMAPK1TDP1ZDHHC20

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505972-B1 Process for producing styrenic copolymer IDEMITSU KOSAN CO (JP) 1997-06-11 EP disclosed
EP-0490269-B1 Graft copolymer and process for producing the same IDEMITSU KOSAN CO (JP) 1996-02-28 EP disclosed
US-5250629-A Graft polymerization of styrene and ethylenically unsaturated monomer using transition metal catalysts, organoaluminum compounds; films, packaging, automobile parts IDEMITSU KOSAN CO., LTD. (JP) 1993-10-05 US disclosed
EP-0505972-A2 Process for producing styrenic copolymer IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-09-30 EP disclosed
EP-0490269-A1 Graft copolymer and process for producing the same IDEMITSU KOSAN COMPANY LIMITED (JP) 1992-06-17 EP disclosed