SCHEMBL29994256

SCHEMBL29994256

CC(C)(C)OC(=O)C(=O)NCC(=O)NCC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.55
TET2 Q6N021 1/20 0.41
PLA2G2A P14555 1/20 0.35
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ITGB1 P05556 1/20 0.33
ITGA5 P08648 1/20 0.33
GAA P10253 1/20 0.33
ALDH1A1 P00352 5/20 0.33
FAAH O00519 5/20 0.33
TDP1 Q9NUW8 3/20 0.32
LMNA P02545 2/20 0.32
MAPT P10636 2/20 0.32
RECQL P46063 2/20 0.32
PTGS2 P35354 1/20 0.32
KDM4E B2RXH2 1/20 0.31
USP2 O75604 1/20 0.31
POLB P06746 1/20 0.31
CYP3A4 P08684 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL27797846 0.93 EGLN1 (0.63) EGLN1TET2PLA2G2AMEN1KMT2A
SCHEMBL999017 0.81 MEN1 (0.46) EGLN1MEN1KMT2AGAAALDH1A1
SCHEMBL8500219 0.81 MEN1 (0.46) EGLN1MEN1KMT2AGAAALDH1A1
SCHEMBL1486144 0.81 MEN1 (0.46) EGLN1MEN1KMT2AGAAALDH1A1
SCHEMBL1000860 0.81 MEN1 (0.46) EGLN1MEN1KMT2AGAAALDH1A1
Water SCHEMBL6670447 0.80 MEN1 (0.45) EGLN1MEN1KMT2AGAAALDH1A1
SCHEMBL10277058 0.80 EGLN1 (0.38) EGLN1MEN1KMT2AITGB1ITGA5
SCHEMBL17690249 0.79 EGLN1 (0.37) EGLN1MEN1KMT2AITGB1ITGA5
SCHEMBL5288195 0.78 EGLN1 (0.48) EGLN1TET2PLA2G2AMEN1KMT2A
SCHEMBL10277175 0.76 EGLN1 (0.41) EGLN1MEN1KMT2AITGB1ITGA5

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
CN-115443134-A Conjugates of cell binding molecules and camptothecin analogs 杭州多禧生物科技有限公司 2022-12-06 CN disclosed