SCHEMBL9701554

SCHEMBL9701554

O=COC1=CC(Cc2ccccc2)C1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GBA1 P04062 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ADH1B P00325 1/20 0.32
ADH1C P00326 1/20 0.32
ADH1A P07327 1/20 0.32
ADH7 P40394 1/20 0.32
HDAC8 Q9BY41 2/20 0.32
DDB1 Q16531 1/20 0.32
CRBN Q96SW2 1/20 0.32
NOS1 P29475 1/20 0.32
NOS2 P35228 1/20 0.32

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
SCHEMBL9700293 0.77 ALDH1A1 (0.37) GBA1ADH1BADH1CADH1AADH7
SCHEMBL29077882 0.66 NOS1 (0.41) GBA1NOS1NOS2
SCHEMBL7565494 0.64 GBA1 (0.45) GBA1
SCHEMBL8651297 0.63 GBA1 (0.37) GBA1
SCHEMBL8651985 0.63 GBA1 (0.40) GBA1ADH1BADH1CADH1AADH7
SCHEMBL29402028 0.62 MEN1 (0.35) NOS1NOS2
SCHEMBL6519938 0.62 GBA1 (0.43) GBA1
SCHEMBL9700271 0.62 MMP3 (0.42)
SCHEMBL10586325 0.62 GBA1 (0.37) GBA1
SCHEMBL21538649 0.62 HPGD (0.50) SMN1; SMN2L3MBTL1

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
US-5120884-A Preparation of hydroxy arylcyclobutenes THE DOW CHEMICAL COMPANY (US) 1992-06-09 US disclosed