SCHEMBL8556571

SCHEMBL8556571

CC1(C)CC(O)(c2csc(S)c2)CCO1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.35
TSHR P16473 2/20 0.33
GAA P10253 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 2/20 0.31
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
LMNA P02545 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
SCHEMBL8555382 0.80 CYP11B2 (0.34) CYP11B2TSHRL3MBTL1ALDH1A1
SCHEMBL12541847 0.70 L3MBTL1 (0.55) CYP11B2TSHRGAAL3MBTL1ALDH1A1
SCHEMBL16430270 0.69 ALDH1A1 (0.56) TSHRGAAL3MBTL1ALDH1A1
SCHEMBL8552745 0.68 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL9049698 0.64 ALOX5 (0.51)
SCHEMBL8556909 0.62 CYP11B2 (0.35) CYP11B2TSHRGAAALDH1A1KDM4E
SCHEMBL24777513 0.59 TSHR (0.41) TSHRGAAL3MBTL1ALDH1A1KDM4E
SCHEMBL27003815 0.59 TSHR (0.41) TSHRGAAL3MBTL1ALDH1A1KDM4E
SCHEMBL24708218 0.59 TSHR (0.41) TSHRGAAL3MBTL1ALDH1A1KDM4E
SCHEMBL19507037 0.57 DAO (0.43) GAAL3MBTL1ALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623614-B1 4-Aryl-4-hydroxy-tetrahydropyrans and 3-aryl-3-hydroxy-tetrahydrofurans as 5-lipoxygenase inhibitors ZENECA LTD (GB) 1998-02-25 EP disclosed
CN-1121715-A 4-aryl-4-hydroxy-tetrahydropyrans and 3-aryl-3-hydroxy-tetrahydrofurans as 5-lipoxygenase inhibitors ZENECA LTD (GB) 1996-05-01 CN disclosed
US-5512594-A ADMINISTERING TO TREAT A MEDICAL CONDITION MEDIATED BY ONE OR MORE LEUKOTRIENES ZENECA LIMITED (GB) 1996-04-30 US disclosed
US-5478842-A Antiinflammatory agents, antiallergens, drugs for treatment of diseases mediated by leukotrienes ZENECA LIMITED (GB) 1995-12-26 US disclosed
WO-1994025453-A1 4-ARYL-4-HYDROXY-TETRAHYDROPYRANS AND 3-ARYL-3-HYDROXY-TETRAHYDROFURANS AS 5-LIPOXYGENASE INHIBITORS ZENECA LIMITED (GB) 1994-11-10 WO disclosed
EP-0623614-A1 4-Aryl-4-hydroxy-tetrahydropyrans and 3-aryl-3-hydroxy-tetrahydrofurans as 5-lipoxygenase inhibitors ZENECA LIMITED (GB) 1994-11-09 EP disclosed