SCHEMBL23832012

SCHEMBL23832012

NCCNc1cc(Cl)cc(NC(=O)Nc2cc(F)ccc2CO)c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
MEN1 O00255 5/20 0.40
KMT2A Q03164 5/20 0.40
RAB9A P51151 4/20 0.40
HTT P42858 4/20 0.40
NPC1 O15118 1/20 0.40
TRPV1 Q8NER1 1/20 0.39
GRIK1 P39086 2/20 0.39
GAA P10253 1/20 0.39
DHODH Q02127 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
LMNA P02545 1/20 0.37
IDH1 O75874 1/20 0.37
PKM P14618 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
SCHEMBL30105120 1.00 MAPT (0.42) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL23831942 0.92 SMN1; SMN2 (0.42) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL30105224 0.92 SMN1; SMN2 (0.42) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL30105249 0.91 TRPV1 (0.41) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL23832067 0.91 TRPV1 (0.41) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL23831587 0.91 GRIK1 (0.43) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL30105318 0.91 RAB9A (0.42) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL23831596 0.91 RAB9A (0.42) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL30105069 0.91 GRIK1 (0.43) MAPTSMN1; SMN2MEN1KMT2ARAB9A
SCHEMBL23831891 0.89 GRIK1 (0.44) MAPTSMN1; SMN2MEN1KMT2ARAB9A

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