SCHEMBL9834608

SCHEMBL9834608

CS(=O)(=O)OCCC1CCc2sc(C=O)cc2C1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TBXAS1 P24557 1/20 0.32
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
GPR55 Q9Y2T6 1/20 0.31
NPC1 O15118 2/20 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
SCHEMBL9836586 0.88 RAB9A (0.35) RAB9AMEN1KMT2ATBXAS1ALDH1A1
SCHEMBL9836067 0.80 TBXAS1 (0.50) RAB9AMEN1KMT2ATBXAS1ALDH1A1
SCHEMBL9870926 0.78 RAB9A (0.43) RAB9AMEN1KMT2ATBXAS1ALDH1A1
SCHEMBL9834147 0.78 TBXAS1 (0.33) TBXAS1
SCHEMBL9835750 0.76 DRD2 (0.49) ALDH1A1KDM4E
SCHEMBL11531913 0.68 RAB9A (0.37) RAB9AMEN1KMT2AALDH1A1KDM4E
SCHEMBL9835043 0.68 TBXAS1 (0.52) RAB9AMEN1KMT2ATBXAS1ALDH1A1
SCHEMBL5635575 0.66 IDO1 (0.54) ALDH1A1KDM4E
SCHEMBL9836834 0.66 ALDH1A1 (0.44) RAB9AMEN1KMT2ATBXAS1ALDH1A1
SCHEMBL3235870 0.65 KDM4E (0.40) ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0240107-B1 THIANAPHTHENE DERIVATIVES, THEIR PRODUCTION AND USE Sankyo Company Limited (JP) 1991-08-21 EP disclosed
US-5021444-A Anticoagulants SANKYO COMPANY LIMITED (JP) 1991-06-04 US disclosed
US-4847272-A ANTICOAGULANTS SANKYO COMPANY LIMITED (JP) 1989-07-11 US disclosed
EP-0240107-A1 Thianaphthene derivatives, their production and use Sankyo Company Limited (JP) 1987-10-07 EP disclosed