SCHEMBL11604697

SCHEMBL11604697

CCCCCCCCCCCCCCCCP(=O)(O)OCC

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.59
CETP P11597 6/20 0.59
LPAR3 Q9UBY5 6/20 0.58
LPAR2 Q9HBW0 3/20 0.58
LPAR1 Q92633 2/20 0.52
FAAH O00519 1/20 0.45

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
SCHEMBL503586 1.00 PPARD (0.59) PPARDCETPLPAR3LPAR2LPAR1
Ethyl Hydrogen Hexylphosphonate SCHEMBL1231607 1.00 PPARD (0.59) PPARDCETPLPAR3LPAR2LPAR1
SCHEMBL28965496 1.00 PPARD (0.59) PPARDCETPLPAR3LPAR2LPAR1
SCHEMBL2184539 1.00 PPARD (0.59) PPARDCETPLPAR3LPAR2LPAR1
Ethyl Hydrogen Heptylphosphonate SCHEMBL21154844 1.00 PPARD (0.59) PPARDCETPLPAR3LPAR2LPAR1
SCHEMBL8070324 1.00 PPARD (0.59) PPARDCETPLPAR3LPAR2LPAR1
SCHEMBL3981741 1.00 PPARD (0.59) PPARDCETPLPAR3LPAR2LPAR1
SCHEMBL11604665 1.00 PPARD (0.59) PPARDCETPLPAR3LPAR2LPAR1
SCHEMBL503891 1.00 PPARD (0.59) PPARDCETPLPAR3LPAR2LPAR1
Ammonia Solution, Strong SCHEMBL28821886 0.98 CETP (0.57) PPARDCETPLPAR3LPAR2LPAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110499204-B Slideway lubricant 雅富顿化学公司 2023-03-14 CN disclosed
CN-110499204-A Slideway lubricant AFTON CHEMICAL CORP 2019-11-26 CN disclosed
US-4069245-A Preparation of phosphonic and/or phosphinic acids HOECHST AKTIENGESELLSCHAFT (DT) 1978-01-17 US disclosed