SCHEMBL27501547

SCHEMBL27501547

NCCCCc1c[c]ccc1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.57
HRH1 P35367 4/20 0.46
HTR2A P28223 2/20 0.41
CYP2A6 P11509 2/20 0.40
SIGMAR1 Q99720 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
LOXL2 Q9Y4K0 1/20 0.37
MAOB P27338 2/20 0.36

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
SCHEMBL8099957 0.94 MAOA (0.48) MAOAHRH1HTR2ACYP2A6SIGMAR1
SCHEMBL1244286 0.85
SCHEMBL8790864 0.84 MAOA (0.38) MAOAHRH1HTR2ASIGMAR1MAOB
SCHEMBL27868131 0.83 TAAR1 (0.50) HTR2ACYP2A6SMN1; SMN2TAAR1LOXL2
SCHEMBL920960 0.83 MAOA (0.50) MAOAHTR2ASIGMAR1MAOB
SCHEMBL922424 0.82 SIGMAR1 (0.50) MAOASIGMAR1MAOB
SCHEMBL3608427 0.82 MAOA (0.34) MAOAHTR2ASIGMAR1
SCHEMBL7367065 0.80 MAOA (0.33) MAOASIGMAR1MAOB
SCHEMBL278144 0.80 TDP1 (0.47) HTR2A
SCHEMBL4849823 0.80 CA2 (0.42) MAOAMAOB

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
CN-1144802-A Pyridazinone derivatives and processes for preparing the same TANABE SEIYAKU CO (JP) 1997-03-12 CN disclosed