SCHEMBL9834672

SCHEMBL9834672

COC(=O)c1cc2c(s1)CCC(COS(C)(=O)=O)=C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.39
HPGD P15428 4/20 0.39
RAB9A P51151 2/20 0.39
MAPK1 P28482 2/20 0.39
NPC1 O15118 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.34
MAPT P10636 2/20 0.34
ATM Q13315 2/20 0.34
GLA P06280 1/20 0.34
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
LMNA P02545 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
PPARG P37231 1/20 0.34
NCOA2 Q15596 1/20 0.34
NCOA1 Q15788 1/20 0.34
NCOA3 Q9Y6Q9 1/20 0.34
ALDH1A1 P00352 3/20 0.34
CSNK2A2 P19784 1/20 0.33

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
SCHEMBL9834944 0.81 KDM4E (0.42) KDM4EHPGDRAB9AMAPK1NPC1
SCHEMBL9836567 0.76
SCHEMBL9834618 0.71 TBXAS1 (0.52) KDM4ENPC1GAANPSR1ALDH1A1
SCHEMBL9837256 0.71
SCHEMBL9834683 0.69 TBXAS1 (0.40) ALDH1A1HSD17B10
SCHEMBL9834712 0.67 PNMT (0.42) KDM4EHPGDRAB9AMAPK1NPC1
SCHEMBL9836665 0.67 KDM4E (0.42) KDM4EHPGDRAB9AMAPK1NPC1
SCHEMBL13550145 0.67 KDM4E (0.50) KDM4EHPGDRAB9AMAPK1NPC1
SCHEMBL9836834 0.67 ALDH1A1 (0.44) KDM4EHPGDRAB9AMAPK1NPC1
SCHEMBL9837267 0.67 TBXAS1 (0.43) KDM4EHPGDRAB9AMAPK1NPC1

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