SCHEMBL30102243

SCHEMBL30102243

NCCNC(=O)CCN1C(=O)Cc2ccccc2C1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.53
KMT2A Q03164 5/20 0.53
GAA P10253 2/20 0.53
RAB9A P51151 2/20 0.53
APAF1 O14727 2/20 0.53
MAPT P10636 2/20 0.53
CASP1 P29466 1/20 0.53
BLM P54132 1/20 0.53
CASP7 P55210 1/20 0.53
HSD17B10 Q99714 1/20 0.53
HPGD P15428 3/20 0.51
POLB P06746 2/20 0.51
KDM4E B2RXH2 1/20 0.51
NPC1 O15118 1/20 0.51
MEN1 O00255 3/20 0.49
USP2 O75604 1/20 0.47
TDP1 Q9NUW8 1/20 0.45
TSHR P16473 1/20 0.45
HDAC3 O15379 1/20 0.45
HDAC4 P56524 1/20 0.45

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
SCHEMBL24811060 1.00 ALDH1A1 (0.53) ALDH1A1KMT2AGAARAB9AAPAF1
SCHEMBL24812565 0.83 USP2 (0.61) ALDH1A1GAARAB9AHSD17B10HPGD
SCHEMBL24811042 0.81 USP2 (0.49) ALDH1A1KMT2AGAARAB9AAPAF1
SCHEMBL20124834 0.81 KMT2A (0.68) ALDH1A1KMT2AGAARAB9AAPAF1
SCHEMBL24813932 0.81 KMT2A (0.46) ALDH1A1KMT2AGAARAB9AAPAF1
SCHEMBL24813897 0.80 KMT2A (0.62) ALDH1A1KMT2AGAARAB9AAPAF1
SCHEMBL31395586 0.80 KMT2A (0.70) ALDH1A1KMT2AGAARAB9AAPAF1
SCHEMBL24811059 0.80 KMT2A (0.70) ALDH1A1KMT2AGAARAB9AAPAF1
SCHEMBL9393236 0.78 KMT2A (0.57) ALDH1A1KMT2AGAARAB9AAPAF1
SCHEMBL24811062 0.76 USP2 (0.77) ALDH1A1KMT2AGAARAB9AAPAF1

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-2022272133-A2 PROTEIN STABILIZING COMPOUNDS CONTAINING USP7 LIGANDS Stablix, Inc. (US) 2022-12-29 WO disclosed