SCHEMBL9615224

SCHEMBL9615224

COC(=C1C2CC3CC1CC(OC(C)(C)C)(C3)C2)c1cccc(O)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.40
EPHX2 P34913 5/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MEN1 O00255 1/20 0.33
CNR2 P34972 1/20 0.33
KMT2A Q03164 1/20 0.33
MDH1 P40925 1/20 0.31
MDH2 P40926 1/20 0.31
ALOX15 P16050 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 1/20 0.30
PARP1 P09874 1/20 0.30
NPC1 O15118 1/20 0.30
POLB P06746 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL2626946 0.82 ALDH1A1 (0.40) FAAHEPHX2ALDH1A1MAPTHPGD
SCHEMBL8730964 0.82 FAAH (0.44) FAAHEPHX2ALDH1A1MAPTHPGD
SCHEMBL25317885 0.81 FAAH (0.43) FAAHEPHX2ALDH1A1MAPTHPGD
SCHEMBL8735081 0.81 FAAH (0.43) FAAHEPHX2ALDH1A1MAPTHPGD
SCHEMBL30518974 0.81 FAAH (0.43) FAAHEPHX2ALDH1A1MAPTHPGD
SCHEMBL25410597 0.81 FAAH (0.43) FAAHEPHX2ALDH1A1MAPTHPGD
SCHEMBL2626945 0.81 FAAH (0.43) FAAHEPHX2ALDH1A1MAPTHPGD
SCHEMBL8730919 0.81 FAAH (0.43) FAAHEPHX2ALDH1A1MAPTHPGD
SCHEMBL734321 0.79 FAAH (0.43) FAAHEPHX2ALDH1A1MAPTHPGD
SCHEMBL8058782 0.79 FAAH (0.43) FAAHEPHX2ALDH1A1MAPTHPGD

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
JP-4124186-A None JP disclosed
JP-H04124186-A SUBSTITUTED 1,2-DIOXETANE COMPOUND, DETECTION METHOD AND KIT TROPIX INC 1992-04-24 JP disclosed