SCHEMBL9866972

SCHEMBL9866972

O=C1C=C(C2CCCC(C3=CC(=O)NC3=O)C2)C(=O)N1

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.34
MAOB P27338 1/20 0.34
PTPN1 P18031 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
SCHEMBL5202489 0.92 MAOA (0.41) MAOAMAOBPTPN1
SCHEMBL27630042 0.88 MAOA (0.45) MAOAMAOBPTPN1
SCHEMBL28123322 0.86 MAOA (0.44) MAOAMAOBPTPN1
SCHEMBL9250741 0.86 MAOA (0.44) MAOAMAOBPTPN1
SCHEMBL8885354 0.86 MAOA (0.44) MAOAMAOBPTPN1
SCHEMBL28720 0.86 MAOA (0.44) MAOAMAOBPTPN1
Ammonia Solution, Strong SCHEMBL27877904 0.84 MAOA (0.42) MAOAMAOBPTPN1
SCHEMBL8563214 0.83 MAOA (0.34) MAOAMAOB
SCHEMBL548282 0.83 MAOA (0.34) MAOAMAOB
Vinyl Chloride SCHEMBL379531 0.77 MAOA (0.37) MAOAMAOBPTPN1

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-0410152-A1 Rubber composition having excellent dynamic properties SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-01-30 EP disclosed