SCHEMBL898231

SCHEMBL898231

CCCCCOc1cccnn1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 1/20 0.44
LTA4H P09960 1/20 0.41
CYP3A4 P08684 3/20 0.39
CYP2D6 P10635 3/20 0.39
FAAH O00519 2/20 0.39
CYP19A1 P11511 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
LMNA P02545 2/20 0.39
NR5A1 Q13285 1/20 0.38
NFKB1 P19838 2/20 0.38
NFKB2 Q00653 2/20 0.38
RELA Q04206 2/20 0.38
NPC1 O15118 2/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TSHR P16473 1/20 0.38
MGLL Q99685 1/20 0.37
RECQL P46063 1/20 0.37

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
SCHEMBL2130269 0.98 SOAT1 (0.47) SOAT1LTA4HCYP3A4CYP2D6FAAH
SCHEMBL4272287 0.94 CYP2D6 (0.44) SOAT1LTA4HCYP3A4CYP2D6CYP19A1
SCHEMBL4276013 0.89 NPC1 (0.39) SOAT1CYP3A4CYP2D6CYP19A1CYP2C9
SCHEMBL29415429 0.81 ALDH1A1 (0.34) CYP3A4CYP2D6CYP2C9CYP2C19LMNA
SCHEMBL1692004 0.80
SCHEMBL31151688 0.80
SCHEMBL13139432 0.80 NCF1 (0.38) LMNASMN1; SMN2TSHR
SCHEMBL23975682 0.79 TSHR (0.39) CYP3A4FAAHLMNATSHR
SCHEMBL10203014 0.79 PPIA (0.39) POLBTDP1
SCHEMBL28716097 0.79 HTR1B (0.49) CYP3A4CYP2C9TSHRL3MBTL1

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 96 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9012096-B2 Long life lithium batteries with stabilized electrodes UCHICAGO ARGONNE, LLC (US) 2015-04-21 US claimed
US-7851092-B2 Redox shuttles for overcharge protection of lithium batteries U CHICAGO ARGONNE LLC (US) 2010-12-14 US claimed
WO-2006094069-A2 NOVEL REDOX SHUTTLES FOR OVERCHARGE PROTECTION OF LITHIUM BATTERIES UCHICAGO ARGONNE, LLC (US) 2006-09-08 WO claimed
US-20060199080-A1 Novel redox shuttles for overcharge protection of lithium batteries THE UNIVERSITY OF CHICAGO 2006-09-07 US claimed
US-20060147809-A1 Non-aqueous electrolyte of an alkali metal salt, a polar aprotic solvent, and an electrode stabilization additive comprising a linear, branched or cyclic hydrocarbon, other than a spirocyclic hydrocarbon, comprising at least one oxygen atom and at least one aryl, alkenyl or alkynyl group THE UNIVERSITY OF CHICAGO 2006-07-06 US claimed
US-12021226-B2 Cathode materials for secondary batteries UCHICAGO ARGONNE, LLC (US) 2024-06-25 US disclosed
EP-3656009-B1 MODIFIED IONIC LIQUIDS CONTAINING TRIAZINE NOHMS TECH INC (US) 2023-11-15 EP disclosed
CN-110915037-B Electrolyte containing phosphorus 诺姆斯科技公司 2023-11-07 CN disclosed
US-11575125-B2 Patterned anode for lithium-ion batteries UCHICAGO ARGONNE, LLC (US) 2023-02-07 US disclosed
EP-4106070-A1 PHOSPHORUS-CONTAINING ELECTROLYTES Nohms Technologies, Inc. (US) 2022-12-21 EP disclosed
US-11489201-B2 Modified ionic liquids containing phosphorus NOHMs Technologies, Inc. (US) 2022-11-01 US disclosed
EP-3436465-B1 MODIFIED IONIC LIQUIDS CONTAINING PHOSPHORUS NOHMS TECH INC (US) 2022-05-25 EP disclosed
US-7622486-B2 Pyridine compounds, process for their preparation and compositions containing them REDDY US THERAPEUTICS, INC. (US) 2009-11-24 US disclosed
US-20090286157-A1 Surface modification agents for lithium batteries U.S. DEPT. OF ENERGY 2009-11-19 US disclosed
WO-2007078429-A2 ELECTRODE MATERIALS AND LITHIUM BATTERY SYSTEMS UCHICAGO ARGONNE, LLC. (US) 2007-07-12 WO disclosed
US-20070148545-A1 Electrode materials and lithium battery systems THE UNIVERSITY OF CHICAGO 2007-06-28 US disclosed
WO-2006094069-A2 NOVEL REDOX SHUTTLES FOR OVERCHARGE PROTECTION OF LITHIUM BATTERIES UCHICAGO ARGONNE, LLC (US) 2006-09-08 WO disclosed
US-20060199080-A1 Novel redox shuttles for overcharge protection of lithium batteries THE UNIVERSITY OF CHICAGO 2006-09-07 US disclosed
US-20060147809-A1 Non-aqueous electrolyte of an alkali metal salt, a polar aprotic solvent, and an electrode stabilization additive comprising a linear, branched or cyclic hydrocarbon, other than a spirocyclic hydrocarbon, comprising at least one oxygen atom and at least one aryl, alkenyl or alkynyl group THE UNIVERSITY OF CHICAGO 2006-07-06 US disclosed
US-20060084644-A1 Novel pyridine compounds, process for their preparation and compositions containing them DR. REDDY'S LABORATORIES LTD. (IN) 2006-04-20 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 (2 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-11489201-B2 Modified ionic liquids containing phosphorus INPPL1, PLCB3, INPP5D SOAT1 3276/4885LTA4H 2292/4885CYP3A4 3661/4885
US-20060084644-A1 Novel pyridine compounds, process for their preparation and compositions containing them LDLR, LRP6, PLPBP SOAT1 3335/4885LTA4H 2184/4885CYP3A4 4101/4885

“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.