SCHEMBL28944802

SCHEMBL28944802

C[Si](C)(C)OCCC(N)=O

nearest known ligand 0.30

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.30
MEN1 O00255 1/20 0.30
FAAH O00519 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
SOAT1 P35610 1/20 0.30
ALOX15 P16050 1/20 0.30
BLM P54132 1/20 0.30
PMP22 Q01453 1/20 0.30

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
SCHEMBL9955793 0.86 SOAT1 (0.36) KMT2AMEN1FAAHTP53CYP1A2
SCHEMBL6648347 0.79
SCHEMBL3321433 0.78 DUT (0.33)
SCHEMBL28569328 0.76
SCHEMBL12201169 0.75 TSHR (0.32)
SCHEMBL28496240 0.75 TSHR (0.42) TP53
SCHEMBL28481216 0.75 TSHR (0.44) FAAH
SCHEMBL28481217 0.75 CA1 (0.39)
SCHEMBL117814 0.75 ALOX15 (0.31) KMT2AALOX15BLMPMP22
SCHEMBL629917 0.73 TSHR (0.55) KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115650827-A Preparation method, intermediate compound and synthesis method for anthracycline derivatives 戊言医药科技(上海)有限公司 2023-01-31 CN claimed
CN-115650827-A Preparation method, intermediate compound and synthesis method for anthracycline derivatives 戊言医药科技(上海)有限公司 2023-01-31 CN disclosed
CN-115651043-A Preparation method of anthracycline derivative 戊言医药科技(上海)有限公司 2023-01-31 CN disclosed