SCHEMBL13693145

SCHEMBL13693145

CCCN(CC)S(C)(=O)=O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.57
CA12 O43570 4/20 0.52
CA2 P00918 2/20 0.52
CA14 Q9ULX7 2/20 0.52
PER2 O15055 4/20 0.36
MPO P05164 2/20 0.35
SLC6A4 P31645 2/20 0.35
CRY1 Q16526 3/20 0.35
CRY2 Q49AN0 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
CA9 Q16790 2/20 0.34
CA7 P43166 1/20 0.34
RAB9A P51151 1/20 0.34
SLC22A6 Q4U2R8 1/20 0.34
SLC22A8 Q8TCC7 1/20 0.34
ABCC2 Q92887 1/20 0.34
SLC22A12 Q96S37 1/20 0.34
UGT1A7 Q9HAW7 1/20 0.34
SLC22A11 Q9NSA0 1/20 0.34
KDM4E B2RXH2 2/20 0.34

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
SCHEMBL2058088 0.88 CA1 (0.63) CA1CA12CA2CA14PER2
SCHEMBL13064494 0.84 CA1 (0.40) CA1CA12CA2CA14MPO
SCHEMBL15746839 0.82 DNM1 (0.39) CA1CA12CA2CA14MPO
SCHEMBL475392 0.82
SCHEMBL17676553 0.80 DNM1 (0.42) CA1CA12CA2CA9
SCHEMBL17676601 0.80 DNM1 (0.42) CA1CA12CA2CA9
SCHEMBL12967256 0.80 CA1 (0.38) CA1CA12CA2CA14PER2
SCHEMBL28163257 0.80 CA1 (0.60) CA1CA12CA2CA14SMN1; SMN2
SCHEMBL23775289 0.79 CA1 (0.37) CA1CA12CA2CA14MPO
SCHEMBL8241145 0.79 SMN1; SMN2 (0.35) CA1CA12CA2CA14PER2

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
CN-103911615-B Etching agent composite for copper-containing metal 东友精细化工有限公司 2017-08-22 CN claimed
WO-2023141432-A2 APOL1 INHIBITORS AND METHODS OF USE MAZE THERAPEUTICS, INC. (US) 2023-07-27 WO disclosed
EP-3838903-A1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE AS JANUS KINASE INHIBITOR Incyte Holdings Corporation (US) 2021-06-23 EP disclosed
CN-103911615-B Etching agent composite for copper-containing metal 东友精细化工有限公司 2017-08-22 CN disclosed
EP-2797912-B1 AZETIDINE-SUBSTITUTED QUINOXALINE-TYPE PIPERIDINE COMPOUNDS AND USES THEREOF PURDUE PHARMA LP (US) 2016-05-25 EP disclosed
WO-2016044641-A2 CARM1 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-03-24 WO disclosed
WO-2014144169-A1 CARM1 INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2014-09-18 WO disclosed
WO-2009115572-A2 NOVEL HETEROCYCLIC COMPOUNDS AND USES THEROF NOVARTIS AG (CH) 2009-09-24 WO disclosed