SCHEMBL30105137

SCHEMBL30105137

COc1cc(Cl)cc(NC(=O)Nc2cc(Cl)ccc2CO)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.54
▸ PKM P14618 1/20 0.54
▸ HTT P42858 1/20 0.54
▸ GRIK1 P39086 4/20 0.52
▸ KMT2A Q03164 4/20 0.48
▸ MEN1 O00255 3/20 0.48
▸ P2RX1 P51575 1/20 0.46
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ VSIG8 P0DPA2 1/20 0.44
▸ IDH1 O75874 1/20 0.44
▸ CNR1 P21554 2/20 0.44
▸ MARS1 P56192 1/20 0.43
▸ PTGER3 P43115 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42

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
SCHEMBL23831902 1.00 MAPT (0.54) MAPTPKMHTTGRIK1KMT2A
SCHEMBL30105314 0.91 MAPT (0.52) MAPTPKMHTTGRIK1KMT2A
SCHEMBL30105022 0.91 MAPT (0.52) MAPTPKMHTTGRIK1KMT2A
SCHEMBL23832101 0.91 MAPT (0.52) MAPTPKMHTTGRIK1KMT2A
SCHEMBL23831730 0.91 MAPT (0.52) MAPTPKMHTTGRIK1KMT2A
SCHEMBL23831994 0.90 LMNA (0.44) MAPTPKMHTTGRIK1KMT2A
SCHEMBL30104939 0.90 LMNA (0.44) MAPTPKMHTTGRIK1KMT2A
SCHEMBL23831985 0.90 MAPT (0.51) MAPTPKMHTTGRIK1KMT2A
SCHEMBL23831786 0.90 GRIK1 (0.52) MAPTPKMHTTGRIK1KMT2A
SCHEMBL30105316 0.90 GRIK1 (0.52) MAPTPKMHTTGRIK1KMT2A

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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