SCHEMBL27077627

SCHEMBL27077627

O=C(Nc1cc(Cl)nc(Cl)c1)Nc1cccc(Br)c1CO

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S1PR2 O95136 3/20 0.54
▸ RAB9A P51151 5/20 0.44
▸ NPC1 O15118 4/20 0.44
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ LMNA P02545 3/20 0.44
▸ HTT P42858 2/20 0.44
▸ CASP3 P42574 2/20 0.44
▸ SENP7 Q9BQF6 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ SENP8 Q96LD8 1/20 0.44
▸ SENP6 Q9GZR1 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.41
▸ CXCR2 P25025 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ TRPV1 Q8NER1 2/20 0.41
▸ IGF1R P08069 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ GRIK1 P39086 1/20 0.40
▸ CXCR1 P25024 1/20 0.39

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
SCHEMBL23831858 0.87 DHODH (0.53) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL23831610 0.87 S1PR2 (0.57) S1PR2RAB9ANPC1MEN1KMT2A
SCHEMBL23831606 0.86 SMARCA2 (0.54) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL23831865 0.85 RAB9A (0.44) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL30105265 0.85 S1PR2 (0.54) S1PR2RAB9ANPC1MEN1KMT2A
SCHEMBL23832001 0.85 S1PR2 (0.54) S1PR2RAB9ANPC1MEN1KMT2A
SCHEMBL23832036 0.84 RAB9A (0.49) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL30105021 0.84 DHODH (0.47) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL27077622 0.84 DHODH (0.47) RAB9ANPC1MEN1KMT2ALMNA
SCHEMBL23831862 0.83 MEN1 (0.60) RAB9ANPC1MEN1KMT2ALMNA

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-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
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