SCHEMBL23831982

SCHEMBL23831982

O=C(Nc1cccc(F)c1)Nc1cccc(Br)c1CO

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.59
KMT2A Q03164 9/20 0.59
MAPT P10636 5/20 0.59
RAB9A P51151 7/20 0.55
TRPV1 Q8NER1 2/20 0.52
GRIK1 P39086 1/20 0.49
MTOR P42345 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49
NPC1 O15118 4/20 0.49
HTT P42858 2/20 0.49
LMNA P02545 2/20 0.49
ALDH1A1 P00352 1/20 0.48
KDM4E B2RXH2 1/20 0.47
PKM P14618 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
PTGER3 P43115 1/20 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
SCHEMBL23831650 0.91 MEN1 (0.47) MEN1KMT2AMAPTRAB9ATRPV1
SCHEMBL23831605 0.87 MEN1 (0.53) MEN1KMT2AMAPTRAB9ATRPV1
SCHEMBL30105198 0.87 MEN1 (0.44) MEN1KMT2AMAPTRAB9ATRPV1
SCHEMBL23831687 0.87 MEN1 (0.44) MEN1KMT2AMAPTRAB9ATRPV1
SCHEMBL30104932 0.87 MEN1 (0.53) MEN1KMT2AMAPTRAB9ATRPV1
SCHEMBL30105361 0.86 MEN1 (0.61) MEN1KMT2AMAPTRAB9ATRPV1
SCHEMBL30792348 0.86 TRPV1 (0.54) MEN1KMT2AMAPTRAB9ATRPV1
SCHEMBL23831977 0.86 TRPV1 (0.54) MEN1KMT2AMAPTRAB9ATRPV1
SCHEMBL23831796 0.86 MEN1 (0.61) MEN1KMT2AMAPTRAB9ATRPV1
SCHEMBL23831714 0.85 MEN1 (0.48) MEN1KMT2AMAPTRAB9ATRPV1

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