SCHEMBL23831978

SCHEMBL23831978

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.46
MEN1 O00255 6/20 0.46
MAPT P10636 5/20 0.46
LMNA P02545 4/20 0.46
HTT P42858 3/20 0.46
GRIK1 P39086 3/20 0.45
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
DHODH Q02127 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MAPK1 P28482 1/20 0.37
GRIK2 Q13002 1/20 0.37

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
SCHEMBL30105176 1.00 KMT2A (0.46) KMT2AMEN1MAPTLMNAHTT
SCHEMBL23831791 0.92 GRIK1 (0.42) KMT2AMEN1MAPTLMNAHTT
SCHEMBL30105260 0.92 GRIK1 (0.42) KMT2AMEN1MAPTLMNAHTT
SCHEMBL30104975 0.91 KMT2A (0.46) KMT2AMEN1MAPTLMNAHTT
SCHEMBL23831602 0.91 KMT2A (0.46) KMT2AMEN1MAPTLMNAHTT
SCHEMBL23831792 0.89 LMNA (0.42) KMT2AMEN1MAPTLMNAHTT
SCHEMBL30105003 0.89 LMNA (0.42) KMT2AMEN1MAPTLMNAHTT
SCHEMBL23831702 0.89 GRIK1 (0.45) KMT2AMEN1MAPTLMNAHTT
SCHEMBL30105276 0.89 GRIK1 (0.45) KMT2AMEN1MAPTLMNAHTT
SCHEMBL23831644 0.89 GRIK1 (0.51) KMT2AMEN1MAPTLMNAHTT

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