SCHEMBL13610227

SCHEMBL13610227

CCCCCCCCCCCCCCCCCCCCCCCCCCCCOCc1coc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.47
MGLL Q99685 1/20 0.47
CA2 P00918 1/20 0.41
MAOB P27338 4/20 0.40
DRD2 P14416 1/20 0.37
SLC6A4 P31645 1/20 0.37
PSMB8 P28062 2/20 0.36
PSMB5 P28074 2/20 0.36
ALDH2 P05091 1/20 0.36
TSHR P16473 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL30956093 0.80 CA2 (0.46) FAAHMGLLCA2MAOBPSMB8
SCHEMBL669427 0.78 CA2 (0.47) FAAHMGLLCA2MAOBDRD2
SCHEMBL3799544 0.76 CA2 (0.49) CA2MAOBDRD2SLC6A4PSMB8
SCHEMBL6992883 0.74 MAOB (0.46) CA2MAOBPSMB8PSMB5
SCHEMBL28809537 0.74 CNR1 (0.46)
SCHEMBL28262225 0.74 CNR1 (0.46)
SCHEMBL28097226 0.74 CNR1 (0.46)
SCHEMBL30956085 0.73 CA2 (0.41) FAAHMGLLCA2MAOBDRD2
SCHEMBL10385040 0.73 MEN1 (0.44) FAAHMGLLTSHRALDH1A1LMNA
SCHEMBL2091115 0.73 PSMB5 (0.45) FAAHMGLLCA2MAOBPSMB8

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
US-7615641-B2 Long chain aliphatic alcohol derivatives and methods of making and using same SINO PHARMACEUTICALS CORPORATION (CA) 2009-11-10 US disclosed
US-7615641-B2 Long chain aliphatic alcohol derivatives and methods of making and using same SINO PHARMACEUTICALS CORPORATION (CA) 2009-11-10 US disclosed