SCHEMBL27328769

SCHEMBL27328769

COC(=O)[C@@H](Cc1ccccc1)N(CCN)OC(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
CA12 O43570 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
LMNA P02545 1/20 0.41
GLA P06280 1/20 0.41
EPOR P19235 2/20 0.40
KMT2A Q03164 3/20 0.40
MEN1 O00255 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TSHR P16473 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A3 Q01959 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ANPEP P15144 2/20 0.39
ATM Q13315 1/20 0.39
SLC7A5 Q01650 1/20 0.39
MMP2 P08253 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
SCHEMBL27328793 1.00 ALDH1A1 (0.41) ALDH1A1CA12CA2CA7CA9
SCHEMBL27331579 0.92 CA12 (0.42) CA12CA7CA9CA14EPOR
SCHEMBL27330494 0.88 EPOR (0.41) EPORKMT2AMEN1SMN1; SMN2TSHR
SCHEMBL27330847 0.86 EPOR (0.44) LMNAEPORKMT2AMEN1SMN1; SMN2
SCHEMBL27334288 0.83 EPOR (0.38) ALDH1A1LMNAEPORKMT2ASMN1; SMN2
SCHEMBL27332527 0.81 MEN1 (0.46) LMNAKMT2AMEN1SMN1; SMN2TSHR
SCHEMBL27328766 0.80 IDO1 (0.44) TDP1ATM
SCHEMBL31299894 0.72 ALDH1A1 (0.55) ALDH1A1CA12CA2CA7CA9
SCHEMBL7030656 0.72 ALDH1A1 (0.55) ALDH1A1CA12CA2CA7CA9
SCHEMBL7030654 0.72 ALDH1A1 (0.55) ALDH1A1CA12CA2CA7CA9

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-2024097355-A1 DEUBIQUITINASE-TARGETING CHIMERAS AND RELATED METHODS VICINITAS THERAPEUTICS, INC. (US) 2024-05-10 WO disclosed