SCHEMBL21180911

SCHEMBL21180911

N#CCCN1CN(CCC#N)CN(CCC#N)C1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.68
PKM P14618 1/20 0.68
POLB P06746 2/20 0.59
SMN1; SMN2 Q16637 1/20 0.54
MAPT P10636 3/20 0.42
TDP1 Q9NUW8 1/20 0.41
GAA P10253 4/20 0.36
TSHR P16473 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.34
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
LOX P28300 1/20 0.33
LOXL3 P58215 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
CYP3A4 P08684 1/20 0.33
HSD17B10 Q99714 1/20 0.33
LMNA P02545 2/20 0.32
KMT2A Q03164 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL23922345 0.89 ALDH1A1 (0.56) ALDH1A1PKMPOLBSMN1; SMN2MAPT
SCHEMBL25800801 0.87 ALDH1A1 (0.54) ALDH1A1PKMPOLBSMN1; SMN2MAPT
SCHEMBL6375310 0.87 ALDH1A1 (0.54) ALDH1A1PKMPOLBSMN1; SMN2MAPT
SCHEMBL21500122 0.87 ALDH1A1 (0.54) ALDH1A1PKMPOLBSMN1; SMN2MAPT
SCHEMBL11051019 0.84 POLB (0.77) ALDH1A1PKMPOLBSMN1; SMN2MAPT
Hydrochloric Acid SCHEMBL27558132 0.83 ALDH1A1 (0.50) ALDH1A1PKMPOLBSMN1; SMN2MAPT
SCHEMBL383162 0.81
SCHEMBL1344289 0.81 ALDH1A1 (1.00) ALDH1A1PKMPOLBSMN1; SMN2MAPT
SCHEMBL27558130 0.80 ALDH1A1 (0.46) ALDH1A1PKMPOLBSMN1; SMN2MAPT
SCHEMBL22725787 0.78 ALDH1A1 (0.62) ALDH1A1PKMPOLBSMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4307427-A1 NON-AQUEOUS ELECTROLYTE SOLUTION COMPOSITION AND LITHIUM SECONDARY BATTERY COMPRISING SAME LG Energy Solution, Ltd. (KR) 2024-01-17 EP disclosed
EP-3514882-B1 ELECTROLYTE SOLUTION AND ELECTROCHEMICAL DEVICE CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2023-12-13 EP disclosed
EP-3809506-B1 LITHIUM ION BATTERY AND DEVICE CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2023-12-13 EP disclosed
EP-3787089-B1 LITHIUM-ION BATTERY AND APPARATUS CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2023-11-22 EP disclosed
EP-3796449-B1 LITHIUM-ION BATTERY AND DEVICE COMPRISING THE SAME CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2023-11-15 EP disclosed
EP-3799183-B1 LITHIUM-ION BATTERY AND DEVICE COMPRISING THE SAME CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2023-11-01 EP disclosed
EP-3809507-B1 LITHIUM-ION BATTERY AND DEVICE COMPRISING THE SAME CONTEMPORARY AMPEREX TECHNOLOGY CO LTD (CN) 2023-10-11 EP disclosed
WO-2023167431-A1 NON-AQUEOUS ELECTROLYTE SOLUTION COMPOSITION AND LITHIUM SECONDARY BATTERY COMPRISING SAME 주식회사 엘지에너지솔루션 2023-09-07 WO disclosed
US-11695157-B2 Lithium-ion battery and apparatus CONTEMPORARY AMPEREX TECHNOLOGY CO., LIMITED (CN) 2023-07-04 US disclosed
US-20220393236-A1 LITHIUM-ION BATTERY AND APPARATUS CONTEMPORARY AMPEREX TECHNOLOGY CO., LIMITED (CN) 2022-12-08 US disclosed
EP-3557682-A1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE Contemporary Amperex Technology Co., Limited (CN) 2019-10-23 EP disclosed
EP-3557678-A1 ELECTROLYTE AND BATTERY Contemporary Amperex Technology Co., Limited (CN) 2019-10-23 EP disclosed
EP-3557683-A1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE Contemporary Amperex Technology Co., Limited (CN) 2019-10-23 EP disclosed
EP-3557681-A1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE Contemporary Amperex Technology Co., Limited (CN) 2019-10-23 EP disclosed
US-20190267670-A1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE CONTEMPORARY AMPEREX TECHNOLOGY CO., LIMITED (CN) 2019-08-29 US disclosed
EP-3528331-A1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE Contemporary Amperex Technology Co., Limited (CN) 2019-08-21 EP disclosed
EP-3514879-A1 ELECTROLYTE SOLUTION AND BATTERY Contemporary Amperex Technology Co., Limited (CN) 2019-07-24 EP disclosed
EP-3514882-A1 ELECTROLYTE SOLUTION AND ELECTROCHEMICAL DEVICE Contemporary Amperex Technology Co., Limited (CN) 2019-07-24 EP disclosed
EP-3514881-A1 ELECTROLYTE AND ELECTROCHEMICAL APPARATUS Contemporary Amperex Technology Co., Limited (CN) 2019-07-24 EP disclosed
EP-3514880-A1 ELECTROLYTE AND ELECTROCHEMICAL DEVICE Contemporary Amperex Technology Co., Limited (CN) 2019-07-24 EP 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-11695157-B2 Lithium-ion battery and apparatus KCNN4, CACNB1, CACNA1B ALDH1A1 3985/4885PKM 2028/4885POLB 73/4885
US-20220393236-A1 LITHIUM-ION BATTERY AND APPARATUS CACNB1, LMNB1, KCNN4 ALDH1A1 3460/4885PKM 2375/4885POLB 150/4885

“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.