SCHEMBL30173446

SCHEMBL30173446

Cn1ccc2cc(CCc3ccccc3)ccc21

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.49
HSD11B1 P28845 1/20 0.48
FAAH O00519 3/20 0.47
SLC6A2 P23975 3/20 0.47
SLC6A4 P31645 3/20 0.47
SLC6A3 Q01959 3/20 0.47
CYP2D6 P10635 1/20 0.47
KCNH2 Q12809 1/20 0.47
CYP2A6 P11509 1/20 0.45
CHRNA7 P36544 2/20 0.43
PLAU P00749 1/20 0.41
TRPV1 Q8NER1 1/20 0.39
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
HCRTR1 O43613 1/20 0.39
HCRTR2 O43614 1/20 0.39
HTR6 P50406 1/20 0.39

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
SCHEMBL18876154 0.82 PRKCI (0.52) PRKCIHSD11B1FAAHCYP2A6CHRNA7
SCHEMBL14402849 0.81 PRKCI (0.50) PRKCIHSD11B1FAAHCYP2A6CHRNA7
SCHEMBL20562931 0.81 PRKCI (0.59) PRKCIHSD11B1FAAHSLC6A2SLC6A3
SCHEMBL30046101 0.81 PRKCI (0.50) PRKCIHSD11B1FAAHSLC6A2SLC6A4
SCHEMBL28909178 0.81 PRKCI (0.50) PRKCIHSD11B1FAAHSLC6A2SLC6A4
SCHEMBL10111229 0.79 PRKCI (0.49) PRKCIHSD11B1FAAHCYP2A6CHRNA7
SCHEMBL6487657 0.79 OXER1 (0.51) PRKCIFAAHCYP2A6CHRNA7TRPV1
SCHEMBL8738295 0.78 PRKCI (0.55) PRKCIHSD11B1FAAHCYP2A6CHRNA7
SCHEMBL24435113 0.78 PRKCI (0.47) PRKCIHSD11B1FAAHCYP2A6CHRNA7
SCHEMBL12348264 0.78 OXER1 (0.53) PRKCISLC6A2SLC6A4SLC6A3CYP2A6

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115772058-B Reduction method of aromatic internal olefins 南通大学 2024-08-16 CN disclosed
CN-115772058-A Reduction method of aromatic internal olefin 南通大学 2023-03-10 CN disclosed