SCHEMBL16635469

SCHEMBL16635469

CC(C)C(CO)NC(=O)C(C)(C)CCl

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.35
RIPK1 Q13546 1/20 0.34
MEN1 O00255 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CNR2 P34972 1/20 0.31
CNR1 P21554 2/20 0.31
GRN P28799 1/20 0.30
SORT1 Q99523 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
SCHEMBL12119372 1.00 CA1 (0.35) CA1CA2CA7HTTLMNA
SCHEMBL24176580 0.81 TDP1 (0.39) CA1CA2CA7LMNARIPK1
SCHEMBL29463584 0.80 CA1 (0.39) CA1CA2CA7RIPK1CNR2
SCHEMBL25590149 0.80 CA1 (0.39) CA1CA2CA7RIPK1ALDH1A1
SCHEMBL4344360 0.80 CA1 (0.39) CA1CA2CA7RIPK1CNR2
SCHEMBL25592327 0.80 CA1 (0.39) CA1CA2CA7RIPK1ALDH1A1
SCHEMBL18219784 0.80 CA1 (0.39) CA1CA2CA7RIPK1ALDH1A1
SCHEMBL13299878 0.79 HTT (0.36) HTTLMNARIPK1MEN1ALDH1A1
SCHEMBL12119396 0.79 HTT (0.36) HTTLMNARIPK1MEN1ALDH1A1
SCHEMBL21789729 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11970512-B2 Amphotericin B derivatives with improved therapeutic index THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2024-04-30 US disclosed
CN-110407898-B Amphotericin B derivatives with improved therapeutic index 伊利诺伊大学评议会 2023-12-01 CN disclosed
US-20220056066-A1 AMPHOTERICIN B DERIVATIVES WITH IMPROVED THERAPEUTIC INDEX THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2022-02-24 US disclosed
US-11117920-B2 Amphotericin B derivatives with improved therapeutic index THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2021-09-14 US disclosed
US-11028114-B2 Amphotericin B derivatives with improved therapeutic index THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2021-06-08 US disclosed
US-20190345187-A1 AMPHOTERICIN B DERIVATIVES WITH IMPROVED THERAPEUTIC INDEX THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2019-11-14 US disclosed
US-10323057-B2 Amphotericin B derivatives with improved therapeutic index THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2019-06-18 US disclosed
US-20180273571-A1 CONCISE SYNTHESIS OF UREA DERIVATIVES OF AMPHOTERICIN B THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS 2018-09-27 US disclosed
EP-3055030-B1 AMPHOTERICIN B DERIVATIVES WITH IMPROVED THERAPEUTIC INDEX UNIV ILLINOIS (US) 2018-05-02 EP disclosed
EP-3242554-A1 CONCISE SYNTHESIS OF UREA DERIVATIVES OF AMPHOTERICIN B The Board of Trustees of the University of Illionis (US) 2017-11-15 EP disclosed
EP-3055030-A1 AMPHOTERICIN B DERIVATIVES WITH IMPROVED THERAPEUTIC INDEX The Board of Trustees of the University of Illinois (US) 2016-08-17 EP disclosed
US-20160215012-A1 AMPHOTERICIN B DERIVATIVES WITH IMPROVED THERAPEUTIC INDEX THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (IL) 2016-07-28 US disclosed
WO-2016112243-A1 UREA DERIVATIVES OF AMPHOTERICIN B DERIVED FROM SECONDARY AMINES THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2016-07-14 WO disclosed
WO-2016112260-A1 CONCISE SYNTHESIS OF UREA DERIVATIVES OF AMPHOTERICIN B THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2016-07-14 WO disclosed
WO-2016040779-A1 UREA DERIVATIVES OF POLYENE MACROLIDE ANTIBIOTICS THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2016-03-17 WO disclosed
WO-2015054148-A1 AMPHOTERICIN B DERIVATIVES WITH IMPROVED THERAPEUTIC INDEX THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2015-04-16 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 (8 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-20220056066-A1 AMPHOTERICIN B DERIVATIVES WITH IMPROVED THERAPEUTIC INDEX C9, AMPD3, C5 CA1 3394/4885CA2 3877/4885CA7 941/4885
US-20160215012-A1 AMPHOTERICIN B DERIVATIVES WITH IMPROVED THERAPEUTIC INDEX C9, AMPD3, C5 CA1 3394/4885CA2 3877/4885CA7 941/4885
US-20180273571-A1 CONCISE SYNTHESIS OF UREA DERIVATIVES OF AMPHOTERICIN B NAT10, CPS1, ERG28 CA1 2918/4885CA2 2819/4885CA7 664/4885
US-20190345187-A1 AMPHOTERICIN B DERIVATIVES WITH IMPROVED THERAPEUTIC INDEX C9, AMPD3, C5 CA1 3394/4885CA2 3877/4885CA7 941/4885
US-10323057-B2 Amphotericin B derivatives with improved therapeutic index C9, AMPD3, C5 CA1 3394/4885CA2 3877/4885CA7 941/4885
US-11028114-B2 Amphotericin B derivatives with improved therapeutic index C9, AMPD3, C5 CA1 3394/4885CA2 3877/4885CA7 941/4885
US-11117920-B2 Amphotericin B derivatives with improved therapeutic index C9, AMPD3, C5 CA1 3394/4885CA2 3877/4885CA7 941/4885
US-11970512-B2 Amphotericin B derivatives with improved therapeutic index C9, AMPD3, C5 CA1 3394/4885CA2 3877/4885CA7 941/4885

“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.