SCHEMBL5936680

SCHEMBL5936680

Cc1cc(OCCOCc2ccccc2)ccc1COS(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.42
S1PR5 Q9H228 1/20 0.42
MAOB P27338 4/20 0.39
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
MAOA P21397 2/20 0.39
PKM P14618 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39
SENP6 Q9GZR1 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
FFAR1 O14842 3/20 0.39
AR P10275 1/20 0.39
HPGD P15428 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MGLL Q99685 1/20 0.38

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
SCHEMBL3173845 0.89 S1PR1 (0.52) S1PR1S1PR5MAOBRAB9ANPC1
SCHEMBL4163135 0.81 S1PR1 (0.46) S1PR1S1PR5MAOBL3MBTL1TDP1
SCHEMBL6495585 0.77 ALDH1A1 (0.42) PKML3MBTL1HPGDSMN1; SMN2PDIA6
SCHEMBL5277439 0.77 CA1 (0.49) RAB9ANPC1L3MBTL1TDP1FFAR1
SCHEMBL4167398 0.77 MGLL (0.49) RAB9ANPC1L3MBTL1TDP1AR
SCHEMBL2076848 0.75 TSHR (0.50) MAOBRAB9ANPC1MAOAPKM
SCHEMBL214564 0.75 RAB9A (0.46) MAOBRAB9ANPC1MAOAL3MBTL1
SCHEMBL5936645 0.75 MEN1 (0.53) MAOBRAB9ANPC1PKML3MBTL1
SCHEMBL4173929 0.74 S1PR1 (0.46) S1PR1S1PR5MAOBL3MBTL1TDP1
SCHEMBL5936691 0.74 S1PR1 (0.45) S1PR1MAOBRAB9ANPC1MAOA

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-20060035844-A1 Preventive or remedy for diseases caused by hyperglycemia KISSEI PHARMACEUTICAL CO., LTD. (JP) 2006-02-16 US disclosed
EP-1568380-A1 PREVENTIVE OR REMEDY FOR DISEASES CAUSED BY HYPERGLYCEMIA Kissei Pharmaceutical Co., Ltd. (JP) 2005-08-31 EP disclosed