SCHEMBL8847257

SCHEMBL8847257

O=S(=O)(O)c1cnc(S(=O)(=O)O)c(S(=O)(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.47
▸ NAPRT Q6XQN6 1/20 0.35
▸ TSHR P16473 3/20 0.33
▸ LCK P06239 1/20 0.33
▸ FYN P06241 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TET2 Q6N021 1/20 0.33
▸ TDP1 Q9NUW8 2/20 0.32
▸ ING2 Q9H160 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ ALDH1A1 P00352 5/20 0.32
▸ HSD17B10 Q99714 3/20 0.31
▸ NT5E P21589 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ CASP6 P55212 1/20 0.31
▸ TIMP3 P35625 1/20 0.30
▸ PIK3C3 Q8NEB9 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
SCHEMBL5552933 0.76 KDM4E (0.44) KDM4ENAPRTTSHRLCKFYN
SCHEMBL28627428 0.75 KDM4E (0.39) KDM4ENAPRTLCKFYNSMN1; SMN2
SCHEMBL8847117 0.70 HSD17B10 (0.31) LCKFYNTET2TDP1ALDH1A1
SCHEMBL5549771 0.70 KDM4E (0.39) KDM4E
SCHEMBL8847279 0.68 KDM4E (0.35) KDM4ETET2
SCHEMBL10572753 0.68 ALDH1A1 (0.44) KDM4ENAPRTTSHRLCKFYN
SCHEMBL5082291 0.67 NAPRT (0.54) KDM4ENAPRTTSHRLCKFYN
SCHEMBL30587062 0.67 KDM4E (0.40) KDM4ENAPRTTSHRSMN1; SMN2TET2
SCHEMBL7538727 0.67 LCK (0.41) TSHRLCKFYNSMN1; SMN2TDP1
SCHEMBL10296124 0.67 ALDH1A1 (0.54) KDM4ENAPRTTDP1LMNAALDH1A1

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
EP-0603557-B1 Catalyst compositions and catalytic processes PHILLIPS PETROLEUM CO (US) 1997-07-30 — — EP disclosed
US-5461126-A Process of polymerizing olefins using organonickel catalyst compositions PHILLIPS PETROLEUM COMPANY (US) 1995-10-24 — — US disclosed
US-5332708-A Ethylene polymerization catalyst, organonickel compound and a heterocyclic nitrogen compound PHILLIPS PETROLEUM COMPANY (US) 1994-07-26 — — US disclosed
EP-0603557-A1 Catalyst compositions and catalytic processes PHILLIPS PETROLEUM COMPANY (US) 1994-06-29 — — EP disclosed
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