SCHEMBL30312969

SCHEMBL30312969

CC(N)CSc1ccc(O)cc1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOA P21397 8/20 0.66
MAOB P27338 4/20 0.64
TAAR1 Q96RJ0 3/20 0.50
SLC6A2 P23975 2/20 0.50
CA2 P00918 1/20 0.46
SLC6A4 P31645 4/20 0.44
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
NR1H2 P55055 1/20 0.41
SLC6A3 Q01959 1/20 0.38

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
SCHEMBL2480562 0.83 NR1H2 (0.44) MAOAMAOBTAAR1SLC6A2CA2
SCHEMBL3658991 0.81 MAOA (0.42) MAOAMAOBTAAR1SLC6A2CA2
SCHEMBL7975244 0.81 MAOA (0.68) MAOAMAOBSLC6A2SLC6A4SLC6A3
SCHEMBL11162282 0.79 MAOA (0.66) MAOAMAOBSLC6A2SLC6A4CYP2D6
SCHEMBL11260151 0.79 MAOA (0.66) MAOAMAOBSLC6A2SLC6A4CYP2D6
SCHEMBL8909149 0.78 MAOA (1.00) MAOAMAOBTAAR1SLC6A2SLC6A4
SCHEMBL4099623 0.78 MAOA (1.00) MAOAMAOBTAAR1SLC6A2SLC6A4
SCHEMBL8656423 0.78 MAOA (0.40) MAOAMAOBTAAR1SLC6A2CA2
Hydrochloric Acid SCHEMBL8909768 0.77 MAOA (0.96) MAOAMAOBTAAR1SLC6A2SLC6A4
SCHEMBL1549295 0.76 BACE1 (0.51) MAOATAAR1CA2NR1H2

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-4145972-A1 DEVICE AND METHOD FOR SELECTIVELY, MECHANICALLY CONTROLLING WEEDS BY MEANS OF A RESTORABLE EVASIVE MOVEMENT OF TOOL ACTUATOR UNITS Grimme Landmaschinenfabrik GmbH & Co. KG (DE) 2023-03-15 EP disclosed