SCHEMBL9839754

SCHEMBL9839754

Cc1cn(C2CCCO2)c(=O)[nH]c1=O

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.69
ALDH1A1 P00352 2/20 0.69
POLB P06746 2/20 0.69
ESR1 P03372 1/20 0.69
MAPT P10636 1/20 0.69
KMT2A Q03164 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
TK1 P04183 5/20 0.50
DHFR P00374 1/20 0.47
ALB P02768 2/20 0.45
ADRA1A P35348 1/20 0.45
BLM P54132 1/20 0.45
PKM P14618 1/20 0.44

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
SCHEMBL19203480 1.00 LMNA (0.69) LMNAALDH1A1POLBESR1MAPT
SCHEMBL8784500 1.00 LMNA (0.69) LMNAALDH1A1POLBESR1MAPT
SCHEMBL9839633 0.85 ALDH1A1 (0.51) LMNAALDH1A1POLBESR1MAPT
Tegafur SCHEMBL4552 0.82 LMNA (1.00) LMNAALDH1A1POLBESR1MAPT
SCHEMBL9838290 0.82 ALDH1A1 (0.69) LMNAALDH1A1POLBESR1MAPT
Tegafur SCHEMBL8537231 0.82 LMNA (1.00) LMNAALDH1A1POLBESR1MAPT
SCHEMBL9841253 0.82 KMT2A (1.00) LMNAALDH1A1POLBESR1MAPT
Tegafur SCHEMBL4553 0.82 LMNA (1.00) LMNAALDH1A1POLBESR1MAPT
Tegafur SCHEMBL7698456 0.82 LMNA (1.00) LMNAALDH1A1POLBESR1MAPT
Tegafur SCHEMBL22320166 0.81 LMNA (0.97) LMNAALDH1A1POLBESR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021030763-A1 MODIFIED OLIGOMERIC COMPOUNDS AND USES THEREOF IONIS PHARMACEUTICALS, INC. (US) 2021-02-18 WO disclosed
US-5075446-A Synthesis of tetrahydro-2-furylated pyrimidine derivatives KOREA ADVANCED INSTITUTE OF SCIENCE & TECHNOLOGY (KR) 1991-12-24 US disclosed