SCHEMBL23831737

SCHEMBL23831737

O=C(Nc1ccnc(F)c1)Nc1cc(Cl)ccc1CCO

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
TRPV1 Q8NER1 2/20 0.46
GRIK1 P39086 6/20 0.45
KCNH2 Q12809 1/20 0.42
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
SMARCA2 P51531 4/20 0.41
SMARCA4 P51532 3/20 0.41
CNR1 P21554 1/20 0.41
BRAF P15056 1/20 0.40
KDR P35968 1/20 0.40
IRAK4 Q9NWZ3 1/20 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
SCHEMBL30105107 1.00 MEN1 (0.47) MEN1KMT2ATRPV1GRIK1KCNH2
SCHEMBL30105029 0.91 MEN1 (0.49) MEN1KMT2ATRPV1GRIK1KCNH2
SCHEMBL23832115 0.91 MEN1 (0.49) MEN1KMT2ATRPV1GRIK1KCNH2
SCHEMBL30104978 0.88 SMARCA2 (0.56) MEN1KMT2ATRPV1GRIK1SMARCA2
SCHEMBL23831776 0.88 SMARCA2 (0.56) MEN1KMT2ATRPV1GRIK1SMARCA2
SCHEMBL23832023 0.88 HTT (0.46) MEN1KMT2ATRPV1LMNAMAPT
SCHEMBL23832025 0.87 MEN1 (0.47) MEN1KMT2ATRPV1GRIK1MAPT
SCHEMBL30105300 0.86 GRIK1 (0.50) MEN1KMT2ATRPV1GRIK1SMARCA2
SCHEMBL23831701 0.86 GRIK1 (0.50) MEN1KMT2ATRPV1GRIK1SMARCA2
SCHEMBL23831625 0.84 TRPV1 (0.57) MEN1KMT2ATRPV1LMNAMAPT

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