SCHEMBL28742865

SCHEMBL28742865

CN1CCC(C=O)N(c2ccccc2)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.37
▸ HRH3 Q9Y5N1 5/20 0.37
▸ HTR2A P28223 2/20 0.35
▸ HTR2C P28335 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ ACHE P22303 1/20 0.35
▸ CHRM2 P08172 3/20 0.35
▸ CHRM3 P20309 3/20 0.35
▸ CHRM1 P11229 3/20 0.34
▸ OPRM1 P35372 2/20 0.34
▸ DRD3 P35462 2/20 0.34
▸ SLC6A3 Q01959 2/20 0.34
▸ KCNH2 Q12809 2/20 0.34
▸ HTR1A P08908 1/20 0.34
▸ ADRA2A P08913 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ DRD1 P21728 1/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ ADRA1A P35348 1/20 0.34

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
SCHEMBL570426 0.83 USP30 (0.39) MAPK1HRH3MEN1KMT2ASLC6A3
SCHEMBL27499074 0.82 NOTUM (0.42) MAPK1HRH3HTR2AACHECHRM3
SCHEMBL23064587 0.76 FFAR1 (0.46) KMT2A
Benzene SCHEMBL28327725 0.75 FFAR1 (0.41) KMT2AALDH1A1
SCHEMBL27969751 0.75 FFAR1 (0.41) KMT2AALDH1A1
SCHEMBL28468815 0.75 FFAR1 (0.41) KMT2AALDH1A1
SCHEMBL27707889 0.73 HRH3 (0.48) HRH3KCNH2CHRM4
SCHEMBL27992544 0.73 FFAR1 (0.40) MAPK1KMT2AALDH1A1
SCHEMBL27498790 0.73 NCF1 (0.33) —
Toluene SCHEMBL27791508 0.72 FFAR1 (0.41) MEN1KMT2AALDH1A1

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
CN-1215595-C Nonaqueous electrolyte and secondary battery using the same MITSUBISHI CHEM CORP (JP) 2005-08-17 — — CN disclosed
CN-1465117-A Nonaqueous electrolyte and secondary battery using the same MITSUBISHI CHEM CORP (JP) 2003-12-31 — — CN disclosed
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