SCHEMBL7370241

SCHEMBL7370241

O=C[C@@H]1CSCN1C(=O)C=Cc1ccc(OCCCCc2ccccc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 9/20 0.48
S1PR3 Q99500 5/20 0.48
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HPGD P15428 1/20 0.44
FFAR1 O14842 1/20 0.44
AKR1B1 P15121 2/20 0.42
PTPN1 P18031 2/20 0.42
PPARA Q07869 2/20 0.41
PPARG P37231 1/20 0.41
S1PR5 Q9H228 1/20 0.41
CYSLTR2 Q9NS75 1/20 0.41
CYSLTR1 Q9Y271 1/20 0.41
PTPN2 P17706 1/20 0.41
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
GSK3B P49841 1/20 0.41
BACE1 P56817 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
SCHEMBL7370240 1.00 S1PR1 (0.48) S1PR1S1PR3MEN1KMT2AHPGD
SCHEMBL7375339 0.90 HDAC1 (0.43) MEN1KMT2AAKR1B1CYSLTR2CYSLTR1
SCHEMBL7375341 0.90 HDAC1 (0.43) MEN1KMT2AAKR1B1CYSLTR2CYSLTR1
SCHEMBL7293144 0.77 APP (0.51) S1PR1S1PR3MEN1KMT2AFFAR1
SCHEMBL450848 0.77 HRH3 (0.52) S1PR1S1PR3MEN1KMT2AFFAR1
SCHEMBL7293139 0.77 APP (0.51) S1PR1S1PR3MEN1KMT2AFFAR1
SCHEMBL450847 0.77 HRH3 (0.52) S1PR1S1PR3MEN1KMT2AFFAR1
SCHEMBL451122 0.76 S1PR1 (0.61) S1PR1S1PR3MEN1KMT2AHPGD
SCHEMBL451121 0.76 S1PR1 (0.61) S1PR1S1PR3MEN1KMT2AHPGD
SCHEMBL7284483 0.74 S1PR1 (0.48) S1PR1S1PR3MEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0461677-B1 Novel thiazolidine derivatives ONO PHARMACEUTICAL CO (JP) 1997-04-16 EP claimed
EP-0461677-A1 Novel thiazolidine derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1991-12-18 EP claimed
US-4857537-A PREVENTING AMNESIA ONO PHARMACEUTICAL CO., LTD. (JP) 1989-08-15 US claimed
EP-0280956-A1 Thiazolidine derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 1988-09-07 EP claimed
US-4857537-A PREVENTING AMNESIA ONO PHARMACEUTICAL CO., LTD. (JP) 1989-08-15 US disclosed