SCHEMBL745261

SCHEMBL745261

N[C@@H](Cc1ccccc1)C(=O)OCCCCc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
ALPI P09923 1/20 0.54
PKM P14618 1/20 0.54
PTGS1 P23219 1/20 0.54
XIAP P98170 1/20 0.54
SLC7A5 Q01650 1/20 0.54
FFAR1 O14842 1/20 0.50
LTA4H P09960 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.48
NPC1 O15118 1/20 0.48
RECQL P46063 1/20 0.48
RAB9A P51151 1/20 0.48
SLC15A1 P46059 1/20 0.47
NAAA Q02083 1/20 0.47
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
KMT2A Q03164 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GRIK1 P39086 1/20 0.47

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
SCHEMBL28806508 1.00 LMNA (0.57) LMNAALPIPKMPTGS1XIAP
SCHEMBL6368998 0.94 ALPI (0.61) LMNAALPIPKMPTGS1XIAP
SCHEMBL14095415 0.92 ALPI (0.59) LMNAALPIPKMPTGS1XIAP
SCHEMBL19167232 0.92 ALPI (0.59) LMNAALPIPKMPTGS1XIAP
SCHEMBL15590174 0.92 ALPI (0.59) LMNAALPIPKMPTGS1XIAP
SCHEMBL26231121 0.92 ALPI (0.59) LMNAALPIPKMPTGS1XIAP
SCHEMBL14095409 0.90 ALPI (0.61) LMNAALPIPKMPTGS1XIAP
SCHEMBL15679078 0.90 ALPI (0.66) LMNAALPIPKMPTGS1XIAP
SCHEMBL26359430 0.90 ALPI (0.66) LMNAALPIPKMPTGS1XIAP
SCHEMBL23542514 0.89 ALPI (0.59) LMNAALPIPKMPTGS1XIAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2641605-B1 POLYMER DERIVATIVE OF CYTIDINE METABOLISM ANTAGONIST NIPPON KAYAKU KK (JP) 2018-03-07 EP disclosed
US-9018323-B2 Polymer derivative of cytidine metabolic antagonist NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2015-04-28 US disclosed
US-20130331517-A1 Novel Polymer Derivative Of Cytidine Metabolic Antagonist NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2013-12-12 US disclosed
EP-2641605-A1 NOVEL POLYMER DERIVATIVE OF CYTIDINE METABOLISM ANTAGONIST Nippon Kayaku Kabushiki Kaisha (JP) 2013-09-25 EP disclosed
EP-2431403-A1 POLYMER CONJUGATE OF BIOACTIVE SUBSTANCE HAVING HYDROXY GROUP Nippon Kayaku Kabushiki Kaisha (JP) 2012-03-21 EP disclosed