SCHEMBL11098296

SCHEMBL11098296

CSCn1c(=O)c(F)cn(C2CCCO2)c1=O

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.60
ALDH1A1 P00352 4/20 0.57
HDAC1 Q13547 1/20 0.57
HDAC2 Q92769 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
LMNA P02545 2/20 0.50
ESR1 P03372 1/20 0.50
MAPT P10636 1/20 0.50
HSP90AA1 P07900 7/20 0.47
KMT2A Q03164 2/20 0.39
POLB P06746 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.31
GAA P10253 1/20 0.31
P2RX7 Q99572 1/20 0.31
CYP2C19 P33261 1/20 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
SCHEMBL5471316 0.85 HPGD (0.63) HPGDALDH1A1HDAC1HDAC2HDAC6
SCHEMBL5471315 0.85 HPGD (0.63) HPGDALDH1A1HDAC1HDAC2HDAC6
SCHEMBL11096886 0.80 HPGD (0.56) HPGDALDH1A1HDAC1HDAC2HDAC6
SCHEMBL5482495 0.78 HDAC1 (0.56) HPGDALDH1A1HDAC1HDAC2HDAC6
SCHEMBL5475097 0.78 HDAC1 (0.56) HPGDALDH1A1HDAC1HDAC2HDAC6
SCHEMBL4886558 0.78 LMNA (0.57) HPGDALDH1A1HDAC1HDAC2HDAC6
SCHEMBL11438845 0.78 HPGD (0.57) HPGDALDH1A1HDAC1HDAC2HDAC6
SCHEMBL5482492 0.78 HPGD (0.57) HPGDALDH1A1HDAC1HDAC2HDAC6
SCHEMBL13531660 0.78 HPGD (0.57) HPGDALDH1A1HDAC1HDAC2HDAC6
SCHEMBL5475095 0.78 HPGD (0.57) HPGDALDH1A1HDAC1HDAC2HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4481203-A ANTICANCER AGENTS TAIHO PHARMACEUTICAL COMPANY, LIMITED (JP) 1984-11-06 US disclosed