SCHEMBL23831780

SCHEMBL23831780

O=C(Nc1cc(Cl)cc(Br)c1)Nc1cc(Br)ccc1CO

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 4/20 0.52
KMT2A Q03164 7/20 0.47
MEN1 O00255 6/20 0.47
MAPT P10636 5/20 0.47
LMNA P02545 4/20 0.47
HTT P42858 3/20 0.47
RAB9A P51151 3/20 0.45
NPC1 O15118 2/20 0.45
CASP3 P42574 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
GRIK2 Q13002 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
DHODH Q02127 1/20 0.43
P2RY1 P47900 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40

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
SCHEMBL30105202 1.00 GRIK1 (0.52) GRIK1KMT2AMEN1MAPTLMNA
SCHEMBL23831644 0.95 GRIK1 (0.51) GRIK1KMT2AMEN1MAPTLMNA
SCHEMBL30105212 0.95 GRIK1 (0.51) GRIK1KMT2AMEN1MAPTLMNA
SCHEMBL30105044 0.92 GRIK1 (0.58) GRIK1KMT2AMEN1MAPTLMNA
SCHEMBL23831697 0.92 GRIK1 (0.58) GRIK1KMT2AMEN1MAPTLMNA
SCHEMBL23832071 0.90 GRIK1 (0.48) GRIK1KMT2AMEN1MAPTLMNA
SCHEMBL30105046 0.90 GRIK1 (0.48) GRIK1KMT2AMEN1MAPTLMNA
SCHEMBL23831917 0.89 GRIK1 (0.46) GRIK1KMT2AMEN1MAPTLMNA
SCHEMBL23831663 0.89 KMT2A (0.50) GRIK1KMT2AMEN1MAPTLMNA
SCHEMBL30104954 0.89 GRIK1 (0.46) GRIK1KMT2AMEN1MAPTLMNA

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