SCHEMBL23831968

SCHEMBL23831968

NCCNc1cc(Cl)cc(NC(=O)Nc2cc(F)cc(F)c2CO)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.44
DHODH Q02127 1/20 0.36
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
RAB9A P51151 3/20 0.36
MAPT P10636 3/20 0.36
NPSR1 Q6W5P4 1/20 0.36
HTT P42858 4/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.35
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA9 Q16790 2/20 0.35
ALDH1A1 P00352 2/20 0.35
P2RY1 P47900 1/20 0.35
GRIK1 P39086 1/20 0.34
GAA P10253 1/20 0.34
SLC2A1 P11166 1/20 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
SCHEMBL30105269 1.00 CNR1 (0.44) CNR1DHODHMEN1KMT2ARAB9A
SCHEMBL23831784 0.93 CNR1 (0.39) CNR1MEN1KMT2ARAB9AMAPT
SCHEMBL30105078 0.93 CNR1 (0.39) CNR1MEN1KMT2ARAB9AMAPT
SCHEMBL30105087 0.92 CNR1 (0.44) CNR1DHODHMEN1KMT2ARAB9A
SCHEMBL23831669 0.92 CNR1 (0.44) CNR1DHODHMEN1KMT2ARAB9A
SCHEMBL23831675 0.89 CNR1 (0.47) CNR1DHODHMEN1KMT2ARAB9A
SCHEMBL30105240 0.89 CNR1 (0.47) CNR1DHODHMEN1KMT2ARAB9A
SCHEMBL23831685 0.88 NPC1 (0.36) CNR1MEN1KMT2ARAB9AMAPT
SCHEMBL30104964 0.88 NPC1 (0.36) CNR1MEN1KMT2ARAB9AMAPT
SCHEMBL23831936 0.88 CNR1 (0.46) CNR1DHODHMEN1KMT2ARAB9A

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