SCHEMBL28058425

SCHEMBL28058425

O=S(=O)(O)c1ccccc1-n1nnnc1S.[NaH]

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.45
LMNA P02545 4/20 0.45
TP53 P04637 4/20 0.45
HTT P42858 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MYC P01106 1/20 0.44
MAPT P10636 5/20 0.33
P2RX7 Q99572 1/20 0.33
TSHR P16473 3/20 0.33
PTGS2 P35354 2/20 0.31
HSD11B1 P28845 1/20 0.31
HSD17B10 Q99714 2/20 0.31
HPGD P15428 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
GAA P10253 1/20 0.31
GFER P55789 1/20 0.31
POLB P06746 2/20 0.30
APOBEC3A P31941 1/20 0.30
APOBEC3G Q9HC16 1/20 0.30
MEN1 O00255 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
SCHEMBL11686888 0.98 ALDH1A1 (0.46) ALDH1A1LMNATP53HTTSMN1; SMN2
SCHEMBL11275392 0.82 ALDH1A1 (0.45) ALDH1A1LMNATP53HTTSMN1; SMN2
SCHEMBL2210006 0.74 KCNMA1 (0.50) ALDH1A1LMNAHTTMAPTTSHR
SCHEMBL10907367 0.72 PTGS2 (0.41) PTGS2
SCHEMBL6929976 0.72 ALDH1A1 (0.46) ALDH1A1HTTMYCMAPTTSHR
SCHEMBL3393319 0.71 MYC (0.45) ALDH1A1MYC
SCHEMBL8076452 0.71 MYC (0.49) ALDH1A1LMNATP53HTTSMN1; SMN2
SCHEMBL1156164 0.71 LMNA (0.43) ALDH1A1LMNATP53HTTSMN1; SMN2
SCHEMBL6321042 0.70 KCNN4 (0.44) ALDH1A1LMNAHTTSMN1; SMN2MAPT
SCHEMBL14112954 0.70 KCNN4 (0.54)

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
CN-108699368-A Printing ink composition and image forming method 富士胶片株式会社 2018-10-23 CN disclosed
CN-108699369-A Printing ink composition, ink group, image forming method and printed matter 富士胶片株式会社 2018-10-23 CN disclosed
CN-105793740-A Antireflection optical member 富士胶片株式会社 2016-07-20 CN disclosed