SCHEMBL8933866

SCHEMBL8933866

O=S(=O)(O)c1ccc(-c2ccccc2)c(P)c1-c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHAT P28329 1/20 0.38
SNCA P37840 1/20 0.38
TSHR P16473 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HDAC4 P56524 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
MMP1 P03956 2/20 0.36
MMP2 P08253 2/20 0.36
MMP9 P14780 2/20 0.36
MMP8 P22894 2/20 0.36
MMP13 P45452 2/20 0.36
PGAM1 P18669 1/20 0.36
MYC P01106 1/20 0.35
CASP1 P29466 2/20 0.35
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL28147663 0.85 TSHR (0.40) CHATSNCATSHRSMN1; SMN2HDAC4
SCHEMBL8909039 0.81 HNF4A (0.43) CHATSNCATSHRSMN1; SMN2HDAC4
SCHEMBL2521856 0.80 TSHR (0.39) CHATSNCATSHRSMN1; SMN2HDAC4
SCHEMBL13726094 0.78 TSHR (0.47) TSHRSMN1; SMN2CA1CA2MMP2
SCHEMBL2521857 0.78 PTGS2 (0.44) CHATSNCATSHRSMN1; SMN2HDAC4
SCHEMBL28019701 0.78 PGAM1 (0.49) CHATSNCATSHRSMN1; SMN2HDAC4
SCHEMBL14775387 0.77 GNG2 (0.41) SNCATSHRSMN1; SMN2HDAC4HDAC2
SCHEMBL28166154 0.77 TSHR (0.36) CHATSNCATSHRSMN1; SMN2HDAC4
SCHEMBL28898442 0.77 USP7 (0.42) TSHRSMN1; SMN2MMP2MAPTHTT
SCHEMBL232659 0.77 CASP1 (0.47) CHATSNCATSHRSMN1; SMN2HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1996026177-A1 PROCESS FOR PREPARING ARYLACETIC ACID AND ARYLPROPIONIC ACID DERIVATIVES HOECHST CELANESE CORPORATION (US) 1996-08-29 WO claimed
US-5536874-A Process for preparing arylacetic acid and arylpropionic acid derivatives HOECHST CELANESE CORPORATION (US) 1996-07-16 US claimed
WO-1996026177-A1 PROCESS FOR PREPARING ARYLACETIC ACID AND ARYLPROPIONIC ACID DERIVATIVES HOECHST CELANESE CORPORATION (US) 1996-08-29 WO disclosed
US-5536874-A Process for preparing arylacetic acid and arylpropionic acid derivatives HOECHST CELANESE CORPORATION (US) 1996-07-16 US disclosed