SCHEMBL9751809

SCHEMBL9751809

N#CSCCCCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MIF P14174 3/20 0.47
MAOA P21397 3/20 0.47
NAAA Q02083 3/20 0.46
MAOB P27338 4/20 0.45
SIGMAR1 Q99720 3/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
ALDH3A1 P30838 1/20 0.42

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
SCHEMBL18792583 0.98 NAAA (0.49) MIFMAOANAAAMAOBSIGMAR1
SCHEMBL18792621 0.98 NAAA (0.49) MIFMAOANAAAMAOBSIGMAR1
SCHEMBL9751807 0.94 NOS1 (0.47) MIFMAOANAAAMAOBSIGMAR1
SCHEMBL2936984 0.87 MAOA (0.50) MIFMAOAMAOB
SCHEMBL28113384 0.85 MAOA (0.48) MIFMAOAMAOB
SCHEMBL18792581 0.79 HRH1 (0.52) NAAAALDH3A1
SCHEMBL7955538 0.78 MMP12 (0.50) MAOAMAOB
SCHEMBL8763914 0.78 MAOA (0.39) MIFMAOAMAOBALDH3A1
SCHEMBL18784450 0.77 ALDH3A1 (0.47) NAAAMAOBL3MBTL1ALDH3A1
SCHEMBL775567 0.76 CYP1A2 (0.58) MAOAMAOBSIGMAR1L3MBTL1

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-0436005-A1 LABELED POLYPEPTIDE DERIVATIVES. SANDOZ LTD (CH) 1991-07-10 EP disclosed