SCHEMBL25498232

SCHEMBL25498232

CC1CN(Cc2ccc(C3=NCC(c4ccc(C(C)C)cc4)=N3)c3ccccc23)C1

nearest known ligand 0.31

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ ALOX15 P16050 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ HTR6 P50406 1/20 0.30

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
SCHEMBL25498770 0.89 HRH3 (0.35) ACHE
SCHEMBL25499913 0.89 ACHE (0.34) ACHEKDM4EHTT
SCHEMBL25498193 0.88 S1PR1 (0.36) ACHE
SCHEMBL25498247 0.88 MLNR (0.35) ACHE
SCHEMBL25498172 0.88 KDM4E (0.32) KDM4EHTT
SCHEMBL25498219 0.87 S1PR1 (0.36) ACHE
SCHEMBL25498273 0.86 ACHE (0.33) ACHELMNAMAPTHTT
SCHEMBL25499867 0.86 S1PR1 (0.36) ACHEALOX15
SCHEMBL25498237 0.85 HRH3 (0.34) ACHEHTR6
SCHEMBL25499152 0.85 HRH2 (0.33) ACHEHTR6

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-4177255-A1 OXADIAZOLE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION AND USE THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2023-05-10 — — EP disclosed
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