SCHEMBL9486109

SCHEMBL9486109

O=C(O)c1c(F)ccc2cccc(F)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.48
CES1 P23141 2/20 0.48
MEN1 O00255 4/20 0.46
KMT2A Q03164 4/20 0.46
HSD17B10 Q99714 4/20 0.41
ALB P02768 1/20 0.41
TTR P02766 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 1/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
TSHR P16473 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
CYP1A2 P05177 2/20 0.38
HPGD P15428 2/20 0.38

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
SCHEMBL25333425 0.81 HSD17B10 (0.48) MEN1KMT2AHSD17B10ALDH1A1KDM4E
SCHEMBL260553 0.79 CES2 (0.67) CES2CES1MEN1KMT2AALB
SCHEMBL25333424 0.78 HSD17B10 (0.44) MEN1KMT2AHSD17B10ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL7968059 0.77 CES2 (0.64) CES2CES1MEN1KMT2AALB
SCHEMBL3117223 0.77 CES2 (0.64) CES2CES1MEN1KMT2AALB
SCHEMBL5313471 0.76 HSD17B10 (0.64) CES2CES1MEN1KMT2AHSD17B10
SCHEMBL3367134 0.74 HSD17B10 (0.59) MEN1KMT2AHSD17B10ALDH1A1KDM4E
SCHEMBL31429106 0.74 HSD17B10 (0.59) MEN1KMT2AHSD17B10ALDH1A1KDM4E
SCHEMBL3309453 0.73 CES2 (0.50) CES2CES1MEN1KMT2AHSD17B10
SCHEMBL30048528 0.73 CES2 (0.50) CES2CES1MEN1KMT2AHSD17B10

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
US-5256742-A Preparation of poly(arylene sulfide)s from poly(arylene sulfide disulfide) PHILLIPS PETROLEUM COMPANY (US) 1993-10-26 US disclosed
EP-0044184-A2 Blend of polyarylene sulfide and wholly aromatic polyester CELANESE CORPORATION (US) 1982-01-20 EP disclosed
US-4276397-A IMPROVED PROCESSABILITY TO FORM MOLDED ARTICLES CELANESE CORPORATION (US) 1981-06-30 US disclosed