SCHEMBL7804477

SCHEMBL7804477

CCCCCOP(=O)(CCC)OCCCCC

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 8/20 0.56
LPAR2 Q9HBW0 6/20 0.56
LPAR1 Q92633 3/20 0.56
CYP3A4 P08684 2/20 0.52
AKT1 P31749 2/20 0.44
LMNA P02545 1/20 0.44
ESR1 P03372 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
CDC25A P30304 1/20 0.44
AGTR1 P30556 1/20 0.44
ADRA1A P35348 1/20 0.44
KCNH2 Q12809 1/20 0.44
TSHR P16473 1/20 0.40
TERT O14746 1/20 0.40
UCHL3 P15374 1/20 0.40
MAPK14 Q16539 1/20 0.40

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
SCHEMBL28846282 0.94 LPAR3 (0.55) LPAR3LPAR2LPAR1CYP3A4AKT1
SCHEMBL4451507 0.93 CYP3A4 (0.61) LPAR3LPAR2LPAR1CYP3A4TSHR
SCHEMBL777909 0.91 LPAR3 (0.56) LPAR3LPAR2LPAR1CYP3A4AKT1
SCHEMBL2184249 0.91 LPAR3 (0.56) LPAR3LPAR2LPAR1CYP3A4AKT1
SCHEMBL7106488 0.88 LPAR3 (0.59) LPAR3LPAR2LPAR1CYP3A4AKT1
SCHEMBL7540607 0.88 LPAR3 (0.59) LPAR3LPAR2LPAR1CYP3A4AKT1
SCHEMBL3815174 0.88 LPAR3 (0.59) LPAR3LPAR2LPAR1CYP3A4AKT1
SCHEMBL11447220 0.88 LPAR3 (0.59) LPAR3LPAR2LPAR1CYP3A4AKT1
SCHEMBL11671731 0.88 LPAR3 (0.59) LPAR3LPAR2LPAR1CYP3A4AKT1
SCHEMBL11752839 0.88 LPAR3 (0.59) LPAR3LPAR2LPAR1CYP3A4AKT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106848406-B Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery 三菱化学株式会社 2020-09-11 CN disclosed
CN-111048841-A Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2020-04-21 CN disclosed
CN-105633345-B Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2020-01-17 CN disclosed
US-8835581-B2 Neutral layer polymer composition for directed self assembly and processes thereof AZ ELECTRONIC MATERIALS (LUXEMBOURG) S.A.R.L. (LU) 2014-09-16 US disclosed
US-20010025116-A1 Aluminum salts of phosphinic acids TICONA GMBH 2001-09-27 US disclosed
US-6211402-B1 REACTING ESTERS OF PHOSPHINIC ACIDS OR DIPHOSPHINIC ACIDS WITH ALUMINUM HYROXIDE UNDER PRESSURE AT 150 TO 350 DEGREES C. IN PRESENCE OF WATER TO PREPARE HIGH TEMPERATURE MODIFICATION ALUMINUM SALTS TICONA GMBH (DE) 2001-04-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20010025116-A1 Aluminum salts of phosphinic acids PPA1, PHOSPHO1, AGPS LPAR3 1176/4885LPAR2 709/4885LPAR1 577/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.