SCHEMBL23831772

SCHEMBL23831772

O=C(O)Cc1c(Cl)cc(Cl)cc1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 1/20 0.47
TSHR P16473 2/20 0.46
MAPK1 P28482 1/20 0.46
ALDH1A1 P00352 2/20 0.46
CYP1A2 P05177 3/20 0.45
AKR1B1 P15121 1/20 0.43
VCAM1 P19320 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
CYP3A4 P08684 2/20 0.40
HPGD P15428 2/20 0.40
CYP2C19 P33261 2/20 0.40
TTR P02766 1/20 0.40
POLB P06746 1/20 0.39
GPR35 Q9HC97 1/20 0.39
APP P05067 1/20 0.38
GRIA2 P42262 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
SCHEMBL2711927 0.85 GPR35 (0.57) MAPK1ALDH1A1CYP1A2AKR1B1HPGD
SCHEMBL2711921 0.85 GPR35 (0.57) MAPK1ALDH1A1CYP1A2AKR1B1HPGD
SCHEMBL5191843 0.81 AKR1B1 (0.61) FBP1TSHRALDH1A1AKR1B1CYP3A4
SCHEMBL47847 0.81 TSHR (0.41) FBP1TSHRMAPK1ALDH1A1CYP1A2
SCHEMBL47848 0.81 TSHR (0.41) FBP1TSHRMAPK1ALDH1A1CYP1A2
SCHEMBL30105031 0.81 MEN1 (0.42) MAPK1ALDH1A1VCAM1HPGDPOLB
SCHEMBL47846 0.80 TSHR (0.43) FBP1TSHRMAPK1ALDH1A1CYP1A2
SCHEMBL7643608 0.79 TSHR (0.46) FBP1TSHRMAPK1ALDH1A1CYP1A2
SCHEMBL1407953 0.79 ALDH1A1 (0.53) ALDH1A1CYP1A2AKR1B1VCAM1CYP3A4
SCHEMBL7311048 0.77 FBP1 (0.44) FBP1TSHRMAPK1ALDH1A1CYP1A2

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