SCHEMBL25465261

SCHEMBL25465261

C=CC(=O)NCC1CCC(C(=O)O)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLG P00747 1/20 0.46
PLAT P00750 1/20 0.46
LMNA P02545 1/20 0.46
KMT2A Q03164 4/20 0.43
TDP1 Q9NUW8 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 4/20 0.42
TSHR P16473 2/20 0.42
MAPK1 P28482 1/20 0.42
MEN1 O00255 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
EPHX1 P07099 1/20 0.38
VCP P55072 2/20 0.38
ANPEP P15144 1/20 0.38
ENPEP Q07075 1/20 0.38
TGM2 P21980 1/20 0.37
KDM4E B2RXH2 1/20 0.36

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
SCHEMBL368411 0.89
SCHEMBL10729681 0.89 ALDH1A1 (0.52) LMNAKMT2ATDP1ALDH1A1TSHR
SCHEMBL19605699 0.81 TDP1 (0.45) LMNAKMT2ATDP1ALDH1A1TSHR
SCHEMBL30900511 0.81 PLG (0.42) PLGPLATLMNAKMT2ATDP1
SCHEMBL14514537 0.81 EPHX1 (0.52) LMNAKMT2ATDP1ALDH1A1TSHR
SCHEMBL19951575 0.81 KMT2A (0.43) PLGPLATLMNAKMT2ATDP1
SCHEMBL16054834 0.81 LMNA (0.44) PLGPLATLMNAKMT2ATDP1
SCHEMBL16054840 0.81 LMNA (0.44) PLGPLATLMNAKMT2ATDP1
SCHEMBL16054838 0.81 LMNA (0.44) PLGPLATLMNAKMT2ATDP1
SCHEMBL16054837 0.81 LMNA (0.44) PLGPLATLMNAKMT2ATDP1

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
WO-2023086028-A2 ALLENAMIDE LINKERS FOR ANTIBODY-DRUG CONJUGATE NANYANG TECHNOLOGICAL UNIVERSITY (SG) 2023-05-19 WO disclosed