SCHEMBL9260266

SCHEMBL9260266

O=C(O)CCSCCCCCO

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.64
HSD17B10 Q99714 2/20 0.64
KMT2A Q03164 1/20 0.64
TDP1 Q9NUW8 1/20 0.64
GPR84 Q9NQS5 1/20 0.58
FFAR1 O14842 1/20 0.58
FFAR4 Q5NUL3 1/20 0.58
BHMT Q93088 3/20 0.52
CAMK2A Q9UQM7 1/20 0.50
TSHR P16473 3/20 0.46
PLA2G4B P0C869 1/20 0.44
GMNN O75496 1/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
CYP2C9 P11712 1/20 0.42
BLM P54132 1/20 0.42
NFKB1 P19838 1/20 0.42
PMP22 Q01453 1/20 0.42

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
SCHEMBL9264322 1.00 LMNA (0.64) LMNAHSD17B10KMT2ATDP1GPR84
SCHEMBL8176355 0.91 GPR84 (0.73) LMNAHSD17B10KMT2ATDP1GPR84
SCHEMBL8651227 0.91 GPR84 (0.73) LMNAHSD17B10KMT2ATDP1GPR84
SCHEMBL8650019 0.91 GPR84 (0.73) LMNAHSD17B10KMT2ATDP1GPR84
SCHEMBL9262544 0.91 GPR84 (0.73) LMNAHSD17B10KMT2ATDP1GPR84
SCHEMBL8650879 0.91 GPR84 (0.73) LMNAHSD17B10KMT2ATDP1GPR84
SCHEMBL9264906 0.91 GPR84 (0.73) LMNAHSD17B10KMT2ATDP1GPR84
SCHEMBL3913691 0.91 LMNA (0.70) LMNAHSD17B10KMT2ATDP1GPR84
SCHEMBL10567294 0.91 LMNA (0.78) LMNAHSD17B10KMT2ATDP1GPR84
SCHEMBL2596733 0.86 GPR84 (0.65) LMNAHSD17B10KMT2ATDP1GPR84

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
US-5391564-A E.g., rhizoxin-13-yl 3-methylthiopropionate; anticarcinogenic agents SANKYO COMPANY, LIMITED (JP) 1995-02-21 US disclosed
US-5352689-A Rhizoxin derivatives and their use as anti-tumor agents SANKYO COMPANY, LIMITED (JP) 1994-10-04 US disclosed
EP-0350315-B1 RHIZOXIN DERIVATES AND THEIR USE AS ANTI-TUMOR AGENTS SANKYO COMPANY LIMITED (JP) 1993-06-16 EP disclosed
EP-0350315-A1 Rhizoxin derivates and their use as anti-tumor agents SANKYO COMPANY LIMITED (JP) 1990-01-10 EP disclosed