SCHEMBL30105270

SCHEMBL30105270

NC(=O)Nc1ccccc1CCO

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 3/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ TRPV1 Q8NER1 2/20 0.47
▸ ALDH1A1 P00352 4/20 0.45
▸ HPGD P15428 1/20 0.45
▸ GRIN2D O15399 1/20 0.42
▸ GRIN3B O60391 1/20 0.42
▸ GRIN1 Q05586 1/20 0.42
▸ GRIN2A Q12879 1/20 0.42
▸ GRIN2B Q13224 1/20 0.42
▸ GRIN2C Q14957 1/20 0.42
▸ GRIN3A Q8TCU5 1/20 0.42
▸ SIGMAR1 Q99720 1/20 0.42
▸ MAPT P10636 2/20 0.42
▸ NOS3 P29474 1/20 0.41
▸ NOS1 P29475 1/20 0.41
▸ NOS2 P35228 1/20 0.41
▸ SIRT1 Q96EB6 1/20 0.41
▸ GFER P55789 1/20 0.40
▸ MTNR1A P48039 1/20 0.40

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
SCHEMBL4688032 0.85 ALDH1A1 (0.49) GAATRPV1ALDH1A1HPGDMAPT
SCHEMBL7837046 0.84 ALDH1A1 (0.61) GAAKDM4ETRPV1ALDH1A1HPGD
SCHEMBL2487614 0.83 TRPV1 (0.40) GAAKDM4ETRPV1ALDH1A1HPGD
SCHEMBL29581095 0.83 GRIN2D (0.49) GAAKDM4EALDH1A1GRIN2DGRIN3B
SCHEMBL5101721 0.83 ALDH1A1 (0.53) KDM4ETRPV1ALDH1A1HPGDPOLB
SCHEMBL4521444 0.83 L3MBTL1 (0.52) GAAKDM4ETRPV1ALDH1A1HPGD
SCHEMBL1953147 0.83 GRIN2D (0.49) GAAKDM4EALDH1A1GRIN2DGRIN3B
SCHEMBL465541 0.82 GAA (0.52) GAAKDM4EALDH1A1HPGDGRIN2D
SCHEMBL29840042 0.82 GAA (0.52) GAAKDM4EALDH1A1HPGDGRIN2D
SCHEMBL7258705 0.82 ALDH1A1 (0.42) GAATRPV1ALDH1A1HPGDGRIN2D

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 2 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
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