SCHEMBL23831768

SCHEMBL23831768

O=C(Nc1cccc(Br)c1)Nc1cc(Cl)cc(Cl)c1CCO

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 7/20 0.57
GRIK2 Q13002 2/20 0.57
TRPV1 Q8NER1 4/20 0.49
MEN1 O00255 3/20 0.49
HTT P42858 3/20 0.49
KMT2A Q03164 3/20 0.49
LMNA P02545 2/20 0.49
MAPT P10636 2/20 0.49
PTGER3 P43115 1/20 0.48
STING1 Q86WV6 1/20 0.46
ALDH1A1 P00352 1/20 0.44
THRB P10828 1/20 0.44
KDM4E B2RXH2 1/20 0.43
MAPK1 P28482 1/20 0.43

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
SCHEMBL30104983 1.00 GRIK1 (0.57) GRIK1GRIK2TRPV1MEN1HTT
SCHEMBL23832081 0.90 GRIK1 (0.59) GRIK1GRIK2TRPV1MEN1HTT
SCHEMBL30105331 0.90 GRIK1 (0.59) GRIK1GRIK2TRPV1MEN1HTT
SCHEMBL30104989 0.89 KMT2A (0.59) GRIK1TRPV1MEN1HTTKMT2A
SCHEMBL23831770 0.89 KMT2A (0.59) GRIK1TRPV1MEN1HTTKMT2A
SCHEMBL23832019 0.88 TRPV1 (0.56) GRIK1GRIK2TRPV1MEN1HTT
SCHEMBL30105150 0.88 TRPV1 (0.56) GRIK1GRIK2TRPV1MEN1HTT
SCHEMBL27077608 0.88 TRPV1 (0.42) GRIK1GRIK2TRPV1MEN1HTT
SCHEMBL23831903 0.86 TRPV1 (0.42) GRIK1GRIK2TRPV1MEN1HTT
SCHEMBL30105231 0.86 TRPV1 (0.42) GRIK1GRIK2TRPV1MEN1HTT

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