SCHEMBL23831738

SCHEMBL23831738

NCCNc1cc(Cl)cc(NC(=O)Nc2cc(Cl)cc(Cl)c2CCO)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 6/20 0.41
P2RY1 P47900 1/20 0.37
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
DHODH Q02127 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
MAPT P10636 2/20 0.36
RAB9A P51151 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 1/20 0.35
SLC2A1 P11166 1/20 0.34
CNR1 P21554 1/20 0.34
KDR P35968 1/20 0.34
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
CHRNA7 P36544 1/20 0.33

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
SCHEMBL30105197 1.00 TRPV1 (0.41) TRPV1P2RY1MEN1KMT2ADHODH
SCHEMBL23831859 0.94 TRPV1 (0.39) TRPV1MEN1KMT2ACA12CA1
SCHEMBL30105303 0.94 TRPV1 (0.39) TRPV1MEN1KMT2ACA12CA1
SCHEMBL30105065 0.93 TRPV1 (0.39) TRPV1P2RY1MEN1KMT2ACA12
SCHEMBL23832009 0.93 TRPV1 (0.39) TRPV1P2RY1MEN1KMT2ACA12
SCHEMBL23831945 0.92 TRPV1 (0.43) TRPV1P2RY1MEN1KMT2ADHODH
SCHEMBL30105070 0.92 TRPV1 (0.43) TRPV1P2RY1MEN1KMT2ADHODH
SCHEMBL30105108 0.91 MAPT (0.40) TRPV1MEN1KMT2AMAPTRAB9A
SCHEMBL27077618 0.91 MAPT (0.40) TRPV1MEN1KMT2AMAPTRAB9A
SCHEMBL23832063 0.91 P2RY1 (0.39) TRPV1P2RY1MEN1KMT2ADHODH

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