SCHEMBL16009485

SCHEMBL16009485

CC1Cc2ccccc2C(C)C1C

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.42
GRIN2D O15399 1/20 0.39
GRIN3B O60391 1/20 0.39
GRIN1 Q05586 1/20 0.39
GRIN2A Q12879 1/20 0.39
GRIN2B Q13224 1/20 0.39
GRIN2C Q14957 1/20 0.39
GRIN3A Q8TCU5 1/20 0.39
PRCP P42785 1/20 0.39
KDM1A O60341 4/20 0.38
CHRNB2 P17787 2/20 0.38
CHRNA4 P43681 2/20 0.38

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
SCHEMBL410055 0.86 OPRM1 (0.44) OPRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL31124279 0.86 OPRM1 (0.44) OPRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL14555195 0.76 SIGMAR1 (0.42) OPRM1PRCPKDM1A
SCHEMBL12722174 0.76 SIGMAR1 (0.42) OPRM1PRCP
SCHEMBL14555192 0.76 CYP11B2 (0.43) PRCPKDM1A
SCHEMBL11548815 0.76 SIGMAR1 (0.46) OPRM1
SCHEMBL11708052 0.76 OPRM1 (0.38) OPRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL24821526 0.74 OPRM1 (0.44) OPRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL599175 0.74 KDM1A (0.47) OPRM1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL14375539 0.74 OPRM1 (0.42) OPRM1GRIN2DGRIN3BGRIN1GRIN2A

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
EP-2771433-B1 PROCESSES FOR UPGRADING ALGAE OILS AND PRODUCTS THEREOF SAPPHIRE ENERGY INC (US) 2016-04-27 EP disclosed
US-20140256999-A1 PROCESSES FOR UPGRADING ALGAE OILS AND PRODUCTS THEREOF SAPPHIRE ENERGY, INC. 2014-09-11 US disclosed