SCHEMBL8087499

SCHEMBL8087499

O=c1[nH]c(=O)n(C2CCC(CO)CO2)cc1F

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.60
MAPT P10636 2/20 0.60
ESR1 P03372 1/20 0.60
SMN1; SMN2 Q16637 4/20 0.56
TSHR P16473 1/20 0.42
PMP22 Q01453 1/20 0.42
HBB P68871 1/20 0.42
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
KMT2A Q03164 1/20 0.41
ALOX12 P18054 1/20 0.40
ADRA1A P35348 1/20 0.40
TK1 P04183 1/20 0.39

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
SCHEMBL8080110 0.85 SMN1; SMN2 (0.60) LMNAMAPTESR1SMN1; SMN2TSHR
SCHEMBL8088562 0.85 PYGM (0.48) LMNAMAPTESR1SMN1; SMN2TSHR
SCHEMBL8091552 0.85 LMNA (0.51) LMNATSHRPMP22ALDH1A1POLB
SCHEMBL8088531 0.85 TK1 (0.56) LMNAMAPTESR1SMN1; SMN2TSHR
SCHEMBL8087489 0.81 LMNA (0.57) LMNAMAPTESR1SMN1; SMN2TSHR
SCHEMBL8104286 0.79 LMNA (0.62) LMNAMAPTESR1SMN1; SMN2TSHR
SCHEMBL26296051 0.79 LMNA (0.62) LMNAMAPTESR1SMN1; SMN2TSHR
SCHEMBL3437131 0.79 LMNA (0.62) LMNAMAPTESR1SMN1; SMN2TSHR
SCHEMBL21345305 0.79 LMNA (0.62) LMNAMAPTESR1SMN1; SMN2TSHR
SCHEMBL3437129 0.79 LMNA (0.62) LMNAMAPTESR1SMN1; SMN2TSHR

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
JP-3047045-B2 2000-05-29 JP claimed
US-6034087-A VIRICIDE AGAINST HEPATITIS B CHONG KUN DANG CORP. (KR) 2000-03-07 US claimed
EP-0869953-A1 NUCLEOSIDE DERIVATIVES AND PROCESS FOR PREPARING THEREOF CHONG KUN DANG CORP (KR) 1998-10-14 EP claimed
WO-1996012716-A1 NUCLEOSIDE DERIVATIVES AND PROCESS FOR PREPARING THEREOF CHONG KUN DANG CORP. (KR) 1996-05-02 WO claimed