SCHEMBL23831760

SCHEMBL23831760

O=C(Nc1cc(F)cc(NCCO)c1)Nc1cc(Cl)ccc1CO

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 10/20 0.46
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
RAB9A P51151 1/20 0.42
TRPV1 Q8NER1 1/20 0.41
P2RX1 P51575 1/20 0.40
P2RX4 Q99571 1/20 0.40
P2RX7 Q99572 1/20 0.40
CNR1 P21554 2/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA9 Q16790 2/20 0.39
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL30104944 1.00 GRIK1 (0.46) GRIK1MEN1KMT2ARAB9ATRPV1
SCHEMBL23831702 0.93 GRIK1 (0.45) GRIK1MEN1KMT2ARAB9ATRPV1
SCHEMBL30105276 0.93 GRIK1 (0.45) GRIK1MEN1KMT2ARAB9ATRPV1
SCHEMBL30105274 0.92 GRIK1 (0.45) GRIK1MEN1KMT2ARAB9ATRPV1
SCHEMBL23831801 0.92 GRIK1 (0.45) GRIK1MEN1KMT2ARAB9ATRPV1
SCHEMBL23831891 0.91 GRIK1 (0.44) GRIK1MEN1KMT2ARAB9ATRPV1
SCHEMBL30105213 0.91 GRIK1 (0.44) GRIK1MEN1KMT2ARAB9ATRPV1
SCHEMBL23832074 0.90 GRIK1 (0.51) GRIK1MEN1KMT2ARAB9ATRPV1
SCHEMBL23831584 0.89 GRIK1 (0.53) GRIK1MEN1KMT2ARAB9ATRPV1
SCHEMBL30105086 0.89 GRIK1 (0.53) GRIK1MEN1KMT2ARAB9ATRPV1

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