SCHEMBL23831794

SCHEMBL23831794

COc1cc(F)cc(NC(=O)Nc2cc(Cl)ccc2CCO)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.49
HTT P42858 4/20 0.49
PKM P14618 1/20 0.49
GRIK1 P39086 5/20 0.47
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
PTGER3 P43115 3/20 0.43
CNR1 P21554 1/20 0.42
P2RX1 P51575 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
IDH1 O75874 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
SCHEMBL30104990 1.00 MAPT (0.49) MAPTHTTPKMGRIK1NPC1
SCHEMBL23831985 0.91 MAPT (0.51) MAPTHTTPKMGRIK1NPC1
SCHEMBL30105147 0.91 MAPT (0.51) MAPTHTTPKMGRIK1NPC1
SCHEMBL30105210 0.91 MAPT (0.53) MAPTHTTPKMNPC1RAB9A
SCHEMBL23831576 0.91 MAPT (0.53) MAPTHTTPKMNPC1RAB9A
SCHEMBL23832101 0.90 MAPT (0.52) MAPTHTTPKMGRIK1NPC1
SCHEMBL30105022 0.90 MAPT (0.52) MAPTHTTPKMGRIK1NPC1
SCHEMBL23831914 0.89 GRIK1 (0.49) MAPTHTTGRIK1RAB9ASMN1; SMN2
SCHEMBL23831889 0.88 MAPT (0.48) MAPTHTTPKMGRIK1NPC1
SCHEMBL30105186 0.88 MAPT (0.48) MAPTHTTPKMGRIK1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4121415-B1 INHIBITORS OF CYTOKININ OXIDASE DERIVED FROM 1-[2-(HYDROXYALKYL)PHENYL]-3-YLUREA, USE THEREOF AND PREPARATIONS CONTAINING THESE DERIVATIVES UNIV PALACKEHO (CZ) 2024-02-07 EP disclosed
EP-4121415-A1 INHIBITORS OF CYTOKININ OXIDASE DERIVED FROM 1-[2-(HYDROXYALKYL)PHENYL]-3-YLUREA, USE THEREOF AND PREPARATIONS CONTAINING THESE DERIVATIVES Univerzita Palackého v Olomouci (CZ) 2023-01-25 EP disclosed
WO-2021185391-A1 INHIBITORS OF CYTOKININ OXIDASE DERIVED FROM 1-[2-(HYDROXYALKYL)PHENYL]-3-YLUREA, USE THEREOF AND PREPARATIONS CONTAINING THESE DERIVATIVES UNIVERZITA PALACKEHO V OLOMOUCI (CZ) 2021-09-23 WO disclosed