SCHEMBL20677232

SCHEMBL20677232

CC(C)(C)OC(=O)NCCCCC(NCC[Si](C)(C)C)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.58
KMT2A Q03164 5/20 0.58
GAA P10253 1/20 0.58
TDP1 Q9NUW8 7/20 0.50
ATM Q13315 2/20 0.46
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
NPSR1 Q6W5P4 5/20 0.44
POLB P06746 2/20 0.44
CA1 P00915 4/20 0.43
CA2 P00918 4/20 0.43
CA12 O43570 2/20 0.43
CA9 Q16790 2/20 0.43
MAPT P10636 4/20 0.42
ACE P12821 1/20 0.42
ALDH1A1 P00352 1/20 0.41
PAX8 Q06710 1/20 0.41

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
SCHEMBL31031966 1.00 MEN1 (0.58) MEN1KMT2AGAATDP1ATM
SCHEMBL31040386 0.89 MEN1 (0.65) MEN1KMT2AGAATDP1ATM
SCHEMBL31325605 0.89 MEN1 (0.65) MEN1KMT2AGAATDP1ATM
SCHEMBL26789194 0.86 MEN1 (0.61) MEN1KMT2AGAATDP1ATM
SCHEMBL25353243 0.86 MEN1 (0.69) MEN1KMT2AGAATDP1ATM
SCHEMBL25353238 0.86 MEN1 (0.69) MEN1KMT2AGAATDP1ATM
SCHEMBL29107778 0.85 MEN1 (0.60) MEN1KMT2AGAATDP1ATM
SCHEMBL14535129 0.85 MEN1 (0.60) MEN1KMT2AGAATDP1ATM
SCHEMBL28546640 0.84 MEN1 (0.52) MEN1KMT2AGAATDP1ATM
SCHEMBL16760315 0.83 MEN1 (0.65) MEN1KMT2AGAATDP1ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114917361-A Antibody Drug Conjugates (ADC) and antibody prodrug conjugates (APDC) with enzyme cleavable groups 拜耳医药股份有限公司 2022-08-19 CN disclosed
EP-3432934-A1 PRODRUGS OF CYTOTOXIC ACTIVE AGENTS HAVING ENZYMATICALLY CLEAVABLE GROUPS Bayer Pharma Aktiengesellschaft (DE) 2019-01-30 EP disclosed