SCHEMBL28052202

SCHEMBL28052202

O=CC(=O)c1occ2c3ccc(o3)c12

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.32
CSNK2A2 P19784 1/20 0.32
CSNK2B P67870 1/20 0.32
CSNK2A1 P68400 1/20 0.32
CSNK2A3 Q8NEV1 1/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL27903018 0.74 ALDH1A1 (0.31) ALDH1A1MAPK1TDP1
SCHEMBL27870365 0.74 ERN1 (0.31) ALDH1A1MAPK1TDP1
SCHEMBL27802011 0.74 ALDH1A1 (0.31) ALDH1A1MAPK1TDP1
SCHEMBL28007109 0.71
SCHEMBL27577308 0.66 ALDH1A1 (0.36) ALDH1A1MAPK1TDP1
SCHEMBL8620985 0.66 ALDH1A1 (0.41) ALDH1A1MAPK1TDP1
SCHEMBL27902949 0.65 CYP1A2 (0.33) ALDH1A1MAPK1TDP1
SCHEMBL28063966 0.65 JAK2 (0.33) ALDH1A1MAPK1TDP1
SCHEMBL28054286 0.65 ALDH1A1 (0.37) ALDH1A1MAPK1TDP1
SCHEMBL28811793 0.62 SIRT1 (0.37) PIM1ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105971571-B Method and composition for oil well and/or gas well 弗洛泰克化学有限责任公司 2019-10-15 CN disclosed
CN-106837217-B For oil well and/or the composition and method comprising terpenol of gas well 弗洛泰克化学有限责任公司 2019-07-02 CN disclosed
CN-105419750-B Method and composition for oil well and/or gas well 弗洛泰克化学有限责任公司 2019-03-22 CN disclosed
CN-106837217-A For oil well and/or the composition comprising terpenol and method of gas well 弗洛泰克化学有限责任公司 2017-06-13 CN disclosed
CN-105971571-A Methods and compositions for use in oil and/or gas wells CESI化工有限公司 2016-09-28 CN disclosed
CN-105492572-A Methods and compositions for use in oil and/or gas wells CESI CHEMICAL INC 2016-04-13 CN disclosed
CN-105419750-A Methods And Compositions For Use In Oil And/Or Gas Wells CESI CHEMICAL INC 2016-03-23 CN disclosed