SCHEMBL11644409

SCHEMBL11644409

COC(=O)c1cccc2cc(S(=O)(=O)O)cc(C(=O)OC)c12.[NaH]

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA5A P35218 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ HPGD P15428 2/20 0.40
▸ SLC6A2 P23975 1/20 0.40
▸ SLC6A4 P31645 1/20 0.40
▸ SLC6A3 Q01959 1/20 0.40
▸ FFAR4 Q5NUL3 1/20 0.39
▸ LMNA P02545 3/20 0.39
▸ TSHR P16473 1/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ GAA P10253 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL9359948 0.97 SCN9A (0.41) SCN9ACA1CA2CA5ACA9
Potassium Ion SCHEMBL9359938 0.84 DUSP5 (0.46) SCN9ACA1CA2CA5ACA9
SCHEMBL11644402 0.84 DUSP5 (0.49) SCN9ACA1CA2CA5ACA9
SCHEMBL7665161 0.79 HSD17B10 (0.47) CASP6KDM4EALDH1A1HPGDTSHR
SCHEMBL10942840 0.78 CA1 (0.42) SCN9ACA1CA2CA5ACA9
SCHEMBL29576400 0.78 KDM4E (0.58) CA1CA2CA5ACA9KDM4E
SCHEMBL68712 0.78 KDM4E (0.58) CA1CA2CA5ACA9KDM4E
SCHEMBL10617647 0.77 CA12 (0.50) CA1CA2CA9KDM4EALDH1A1
SCHEMBL6389919 0.77 HSD17B10 (0.49) CASP6KDM4EALDH1A1HPGDTSHR
SCHEMBL22861264 0.76 KDM4E (0.48) KDM4EALDH1A1HPGDSLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4076783-A DYEABILITY, MELT SPINNING, ORIENTATION, SULFONATE GROUPS TOYOBO CO., LTD. (JA) 1978-02-28 — — US claimed
US-4076783-A DYEABILITY, MELT SPINNING, ORIENTATION, SULFONATE GROUPS TOYOBO CO., LTD. (JA) 1978-02-28 — — US disclosed
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