SCHEMBL16828348

SCHEMBL16828348

CC(C)(C)COC(=O)C=[N+]=[N-]

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.36
HIF1A Q16665 2/20 0.36
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
HTT P42858 1/20 0.36
CYP2C19 P33261 2/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL28601116 0.78 HTT (0.45) ALDH1A1HIF1AHTTCYP2C19CYP1A2
SCHEMBL4412 0.77
SCHEMBL5611325 0.77 HCAR2 (0.44) ALDH1A1HIF1AKMT2ACYP2C19TP53
SCHEMBL8085681 0.77 HCAR2 (0.44) ALDH1A1HIF1AKMT2ACYP2C19TP53
SCHEMBL5611334 0.77 HCAR2 (0.44) ALDH1A1HIF1AKMT2ACYP2C19TP53
SCHEMBL28285089 0.76
SCHEMBL697706 0.75 ALDH1A1 (0.35) ALDH1A1HIF1AKMT2ACYP2C19TP53
Alcohol SCHEMBL28357108 0.74 HCAR2 (0.43) ALDH1A1CYP2C19CYP1A2CYP2C9
SCHEMBL294874 0.74
SCHEMBL28082232 0.74 MIF (0.35) ALDH1A1HIF1AKMT2AMEN1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4212181-A2 METHYLENE CARBAMATE LINKERS FOR USE WITH TARGETED-DRUG CONJUGATES Seagen Inc. (US) 2023-07-19 EP disclosed
EP-3082878-B1 METHYLENE CARBAMATE LINKERS FOR USE WITH TARGETED-DRUG CONJUGATES SEAGEN INC (US) 2022-10-05 EP disclosed
US-20220054650-A1 Methylene Carbamate Linkers for use with Targeted-Drug Conjugates SEATTLE GENETICS, INC. 2022-02-24 US disclosed
US-11116847-B2 Methylene carbamate linkers for use with targeted-drug conjugates SEAGEN INC. (US) 2021-09-14 US disclosed
EP-3082878-A1 METHYLENE CARBAMATE LINKERS FOR USE WITH TARGETED-DRUG CONJUGATES Seattle Genetics, Inc. (US) 2016-10-26 EP disclosed
US-20160303254-A1 METHYLENE CARBAMATE LINKERS FOR USE WITH TARGETED-DRUG CONJUGATES SEAGEN INC. 2016-10-20 US disclosed
CN-105813653-A Methylene carbamate linkers for use with target-drug conjugates 西雅图基因公司 2016-07-27 CN disclosed
WO-2015095755-A1 METHYLENE CARBAMATE LINKERS FOR USE WITH TARGETED-DRUG CONJUGATES SEATTLE GENETICS, INC. (US) 2015-06-25 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11116847-B2 Methylene carbamate linkers for use with targeted-drug conjugates MCL1, BID, MTDH ALDH1A1 1928/4885HIF1A 2494/4885KMT2A 1132/4885
US-20160303254-A1 METHYLENE CARBAMATE LINKERS FOR USE WITH TARGETED-DRUG CONJUGATES LIG1, LIG4, LIG3 ALDH1A1 1740/4885HIF1A 2550/4885KMT2A 918/4885
US-20220054650-A1 Methylene Carbamate Linkers for use with Targeted-Drug Conjugates MCL1, BID, MTDH ALDH1A1 1928/4885HIF1A 2494/4885KMT2A 1132/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.