SCHEMBL23831777

SCHEMBL23831777

O=C(Nc1cccc(Br)c1)Nc1ccccc1CCO

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.57
PTGER3 P43115 1/20 0.56
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
MAPT P10636 2/20 0.53
STING1 Q86WV6 1/20 0.53
GRIK1 P39086 3/20 0.53
PARP1 P09874 1/20 0.52
GRIK2 Q13002 2/20 0.50
DDX3X O00571 1/20 0.48
GAA P10253 1/20 0.48
GOT1 P17174 1/20 0.47
RAB9A P51151 3/20 0.47
LMNA P02545 3/20 0.47
NPC1 O15118 2/20 0.47
ALDH1A1 P00352 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HTT P42858 3/20 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
SCHEMBL23831933 0.89 STING1 (0.59) TRPV1PTGER3MEN1KMT2AMAPT
SCHEMBL30802676 0.89 STING1 (0.59) TRPV1PTGER3MEN1KMT2AMAPT
SCHEMBL23831828 0.89 TRPV1 (0.56) TRPV1PTGER3MEN1KMT2AMAPT
SCHEMBL29200423 0.85 PTGER3 (0.60) TRPV1PTGER3MEN1KMT2AMAPT
SCHEMBL23831724 0.85 GRIK1 (0.55) TRPV1PTGER3MEN1KMT2AMAPT
SCHEMBL30105335 0.85 GRIK1 (0.74) TRPV1PTGER3MEN1KMT2AMAPT
SCHEMBL23831920 0.85 GRIK1 (0.74) TRPV1PTGER3MEN1KMT2AMAPT
SCHEMBL30105223 0.85 GRIK1 (0.55) TRPV1PTGER3MEN1KMT2AMAPT
SCHEMBL23831812 0.84 TRPV1 (0.63) TRPV1PTGER3MEN1KMT2AMAPT
SCHEMBL6490134 0.84 MGLL (0.65) TRPV1MEN1KMT2AMAPTGRIK1

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