SCHEMBL28337706

SCHEMBL28337706

CCC[C@@H](N)c1cccc(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 2/20 0.42
TAS1R3 Q7RTX0 1/20 0.41
TAS1R1 Q7RTX1 1/20 0.41
ACHE P22303 1/20 0.41
CYP19A1 P11511 3/20 0.39
ROCK1 Q13464 1/20 0.39
ACP3 P15309 1/20 0.39
TAAR1 Q96RJ0 1/20 0.37
PSEN1 P49768 1/20 0.37
PSEN2 P49810 1/20 0.37
APH1B Q8WW43 1/20 0.37
NCSTN Q92542 1/20 0.37
APH1A Q96BI3 1/20 0.37
PSENEN Q9NZ42 1/20 0.37
SLC6A2 P23975 1/20 0.37
SLC6A4 P31645 1/20 0.37
SLC6A3 Q01959 1/20 0.37
TACR1 P25103 2/20 0.37
IDO1 P14902 1/20 0.36
NOS1 P29475 2/20 0.35

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
SCHEMBL12056788 1.00 AOC3 (0.42) AOC3TAS1R3TAS1R1ACHECYP19A1
SCHEMBL28337687 1.00 AOC3 (0.42) AOC3TAS1R3TAS1R1ACHECYP19A1
SCHEMBL23222060 0.88 AOC3 (0.40) AOC3ROCK1
SCHEMBL9848074 0.87 SLC2A1 (0.46) AOC3ACHECYP19A1PSEN1PSEN2
SCHEMBL20274525 0.86 TAAR1 (0.47) AOC3ACHECYP19A1ACP3TAAR1
SCHEMBL24527613 0.85 AOC3 (0.42) AOC3ACHECYP19A1ACP3TAAR1
SCHEMBL4172487 0.84 AOC3 (0.45) AOC3ACHECYP19A1ACP3TAAR1
SCHEMBL17976091 0.84 AOC3 (0.45) AOC3ACHECYP19A1ACP3TAAR1
SCHEMBL24726453 0.83 AOC3 (0.41) AOC3ACHECYP19A1ACP3TAAR1
SCHEMBL9439749 0.81 CPN1 (0.41) AOC3ROCK1SLC6A2SLC6A4SLC6A3

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-110325531-A Benzsulfamide and its purposes as therapeutic agent 泽农医药公司 2019-10-11 CN disclosed