SCHEMBL11530127

SCHEMBL11530127

COc1cc(-c2cc3ccccc3[nH]2)ccc1OS(=O)(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.51
▸ RAB9A P51151 6/20 0.51
▸ NPC1 O15118 5/20 0.51
▸ KDM4E B2RXH2 4/20 0.51
▸ CASP3 P42574 2/20 0.51
▸ SENP8 Q96LD8 2/20 0.51
▸ SENP7 Q9BQF6 2/20 0.51
▸ SENP6 Q9GZR1 2/20 0.51
▸ CA12 O43570 2/20 0.49
▸ CA1 P00915 2/20 0.49
▸ CA2 P00918 2/20 0.49
▸ CA9 Q16790 2/20 0.49
▸ ALDH1A1 P00352 6/20 0.48
▸ MEN1 O00255 5/20 0.48
▸ KMT2A Q03164 5/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ HPGD P15428 3/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.48
▸ GAA P10253 3/20 0.45
▸ LMNA P02545 2/20 0.45

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
Toluene SCHEMBL11596293 0.96 MAPT (0.47) MAPTRAB9ANPC1KDM4ECASP3
SCHEMBL11639272 0.88 RAB9A (0.50) MAPTRAB9ANPC1KDM4ECASP3
SCHEMBL11646159 0.87 CA12 (0.46) MAPTRAB9ANPC1KDM4ECASP3
SCHEMBL11531160 0.86 RAB9A (0.55) MAPTRAB9ANPC1KDM4ECASP3
SCHEMBL11645761 0.85 ALOX15 (0.47) MAPTRAB9ANPC1KDM4ECASP3
SCHEMBL11641017 0.84 CA2 (0.53) MAPTRAB9ANPC1KDM4ECASP3
SCHEMBL11642641 0.84 CA12 (0.45) MAPTRAB9ANPC1KDM4ECASP3
SCHEMBL10796083 0.83 RAB9A (0.67) MAPTRAB9ANPC1KDM4ECASP3
SCHEMBL30770801 0.83 RAB9A (0.67) MAPTRAB9ANPC1KDM4ECASP3
SCHEMBL11644311 0.83 ALOX15 (0.52) MAPTRAB9ANPC1KDM4ECASP3

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-4134909-A THERMOPLASTIC RESIN STABILIZERS LABAZ (FR) 1979-01-16 — — US disclosed
US-4129572-A TO STABILIZE POLYMERS USED IN FOOD PACKAGING INDUSTRY LABAZ (FR) 1978-12-12 — — US disclosed
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