SCHEMBL8611881

SCHEMBL8611881

COc1ccc(COc2ccc(S(=O)(=O)c3ccc(OCC4(C)CO4)cc3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 3/20 0.49
▸ GAA P10253 1/20 0.46
▸ APP P05067 5/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ MAOB P27338 1/20 0.43
▸ CYP19A1 P11511 1/20 0.42
▸ FFAR1 O14842 1/20 0.42
▸ HPGD P15428 2/20 0.42
▸ HRH3 Q9Y5N1 1/20 0.42
▸ ADAMTS4 O75173 1/20 0.42
▸ PTPRZ1 P23471 1/20 0.42
▸ BCHE P06276 1/20 0.41
▸ ACHE P22303 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HTT P42858 1/20 0.41

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
SCHEMBL6301749 0.91 MAOB (0.48) SMN1; SMN2NPC1RAB9AMAOBHPGD
SCHEMBL31349 0.89 CA12 (0.52) SMN1; SMN2NPC1RAB9AMAOBHPGD
SCHEMBL7720231 0.83 PKM (0.51) PKMGAASMN1; SMN2POLBALDH1A1
SCHEMBL1144646 0.82 CA12 (0.45) MAOBFFAR1
SCHEMBL9405446 0.80 CA12 (0.51) SMN1; SMN2NPC1RAB9AMAOBHPGD
SCHEMBL7753235 0.78 PKM (0.75) PKMGAAAPPSMN1; SMN2NPC1
SCHEMBL9617970 0.78 MAOB (0.45) SMN1; SMN2NPC1RAB9AMAOBFFAR1
SCHEMBL5707066 0.78 CA12 (0.43) SMN1; SMN2NPC1RAB9AMAOBCYP19A1
SCHEMBL87194 0.78 BCHE (0.56) PKMGAAAPPSMN1; SMN2NPC1
SCHEMBL12407772 0.78 BCHE (0.56) PKMGAAAPPSMN1; SMN2NPC1

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
EP-0664224-B1 Heat-sensitive recording paper NEW OJI PAPER CO LTD (JP) 1998-04-22 — — EP disclosed
US-5543382-A GLASSINE PAPER, LEUCO DYE AND DEVELOPER NEW OJI PAPER CO., LTD. (JP) 1996-08-06 — — US disclosed
EP-0664224-A2 Heat-sensitive recording paper NEW OJI PAPER CO., LTD. (JP) 1995-07-26 — — EP disclosed
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