SCHEMBL23831721

SCHEMBL23831721

NCCNc1cc(Cl)cc(NC(=O)Nc2cc(Cl)ccc2CCO)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.43
GRIK1 P39086 8/20 0.42
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
CA12 O43570 2/20 0.40
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
CNR1 P21554 1/20 0.39
DHODH Q02127 1/20 0.38
MAPT P10636 4/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
HTT P42858 3/20 0.37
LMNA P02545 2/20 0.37
ALDH1A1 P00352 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL30105345 1.00 TRPV1 (0.43) TRPV1GRIK1MEN1KMT2ACA12
SCHEMBL23831676 0.93 GRIK1 (0.42) TRPV1GRIK1MEN1KMT2ACA12
SCHEMBL30104937 0.93 GRIK1 (0.42) TRPV1GRIK1MEN1KMT2ACA12
SCHEMBL30105118 0.92 GRIK1 (0.49) TRPV1GRIK1MEN1KMT2ACA12
SCHEMBL23831954 0.92 GRIK1 (0.49) TRPV1GRIK1MEN1KMT2ACA12
SCHEMBL23831590 0.92 TRPV1 (0.45) TRPV1GRIK1MEN1KMT2ACA12
SCHEMBL30105288 0.92 TRPV1 (0.45) TRPV1GRIK1MEN1KMT2ACA12
SCHEMBL23832067 0.91 TRPV1 (0.41) TRPV1GRIK1MEN1KMT2ACA12
SCHEMBL30105249 0.91 TRPV1 (0.41) TRPV1GRIK1MEN1KMT2ACA12
SCHEMBL23831587 0.91 GRIK1 (0.43) TRPV1GRIK1MEN1KMT2ACA12

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