SCHEMBL28023911

SCHEMBL28023911

CCCCCCCCCCCCO[CH]C(C)CCCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.39
CA1 P00915 8/20 0.36
CA2 P00918 8/20 0.36
CA9 Q16790 7/20 0.36
CA12 O43570 3/20 0.36
CA7 P43166 3/20 0.36
CA14 Q9ULX7 3/20 0.36
CA3 P07451 2/20 0.36
CA4 P22748 2/20 0.36
CA6 P23280 2/20 0.36
CA5A P35218 2/20 0.36
CA5B Q9Y2D0 2/20 0.36
ADH1B P00325 1/20 0.34
ADH1C P00326 1/20 0.34
ADH1A P07327 1/20 0.34
ADH4 P08319 1/20 0.34
ADH7 P40394 1/20 0.34
PLA2G2C Q5R387 1/20 0.34
SPHK1 Q9NYA1 1/20 0.33
OPRM1 P35372 1/20 0.33

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
SCHEMBL28023405 0.85 CA1 (0.38) DNM1CA1CA2CA9CA12
SCHEMBL7757009 0.81 USP2 (0.42) CA1CA2CA9SPHK1
SCHEMBL6709623 0.81 USP2 (0.42) CA1CA2CA9SPHK1
SCHEMBL9316776 0.81 USP2 (0.42) CA1CA2CA9SPHK1
SCHEMBL4488952 0.80 CA1 (0.40) DNM1CA1CA2CA9CA12
SCHEMBL9254838 0.78 USP2 (0.39) CA1CA2CA9CA12SPHK1
SCHEMBL4500260 0.78 CA1 (0.38) DNM1CA1CA2CA9CA12
SCHEMBL25278301 0.76 ADH1B (0.40) DNM1ADH1BADH1CADH1AADH4
SCHEMBL16338425 0.75 DNM1 (0.44) DNM1CA1CA2CA9CA12
SCHEMBL16338300 0.75 DNM1 (0.44) DNM1CA1CA2CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108884410-A Lubricating oil composition 出光兴产株式会社 2018-11-23 CN disclosed
CN-108848672-A Lubricating oil composition for supercharging-mechanism-equipped engine, method for suppressing low-speed pre-ignition in supercharging-mechanism-equipped engine using same, and method for producing same 出光兴产株式会社 2018-11-20 CN disclosed
CN-106459809-A Lubricating oil composition and method for reducing friction of internal combustion engine 出光兴产株式会社 2017-02-22 CN disclosed
CN-104870621-A Lubricating oil composition IDEMITSU KOSAN CO 2015-08-26 CN disclosed