SCHEMBL1075831

SCHEMBL1075831

CCCCn1ccnc1CCCN

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.54
POLB P06746 1/20 0.54
KMT2A Q03164 1/20 0.54
TLR8 Q9NR97 2/20 0.51
KCNH2 Q12809 4/20 0.40
AGTR1 P30556 1/20 0.38
AGTR2 P50052 1/20 0.38
SPNS2 Q8IVW8 2/20 0.38
ADORA2A P29274 1/20 0.36

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
Hydrochloric Acid SCHEMBL1029443 0.98 ALDH1A1 (0.53) ALDH1A1POLBKMT2ATLR8KCNH2
Bromide SCHEMBL1029841 0.98 ALDH1A1 (0.53) ALDH1A1POLBKMT2ATLR8KCNH2
SCHEMBL27627062 0.93 TLR8 (0.51) ALDH1A1POLBKMT2ATLR8KCNH2
Bromide SCHEMBL28272854 0.92 TLR8 (0.55) ALDH1A1POLBKMT2ATLR8KCNH2
SCHEMBL27627059 0.92 TLR8 (0.54) ALDH1A1POLBKMT2ATLR8KCNH2
SCHEMBL3865520 0.90 TLR8 (0.53) ALDH1A1POLBKMT2ATLR8KCNH2
SCHEMBL10532493 0.90 TLR8 (0.53) ALDH1A1POLBKMT2ATLR8KCNH2
SCHEMBL10530747 0.90 TLR8 (0.53) ALDH1A1POLBKMT2ATLR8KCNH2
SCHEMBL6115033 0.90 ALDH1A1 (0.61) ALDH1A1POLBKMT2ATLR8KCNH2
SCHEMBL1049122 0.90 ALDH1A1 (0.61) ALDH1A1POLBKMT2ATLR8KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111261883-B Preparation method and application of ionic liquid functionalized graphene oxide loaded nano cobaltosic oxide composite material 河北工业大学 2022-08-23 CN claimed
CN-109476803-B Amine compositions useful for making polyurethane foams 赢创运营有限公司 2022-04-12 CN claimed
CN-105845951-B Ionic liquid covalent modification graphene peels off difunctional VPO catalysts of houghite and its preparation method and application 青岛科技大学 2018-02-06 CN claimed
CN-106018519-A Ionic liquid functional composite membrane modified electrode and preparation method and application thereof to detection of chlorophenol 青岛科技大学 2016-10-12 CN claimed
CN-105845951-A Graphene/stripped hydrotalcite bifunctional oxygen catalyst modified covalently by ionic liquid, preparation method and application thereof 青岛科技大学 2016-08-10 CN claimed
EP-2152687-B1 METHOD FOR PRODUCING CARBONATE-TERMINATED COMPOUNDS SALTIGO GMBH (DE) 2011-01-19 EP claimed
CN-110636897-B Laminate containing ionic liquid and method for producing same 株式会社大赛璐 2022-10-14 CN disclosed
CN-111261883-B Preparation method and application of ionic liquid functionalized graphene oxide loaded nano cobaltosic oxide composite material 河北工业大学 2022-08-23 CN disclosed
CN-111261883-B Preparation method and application of ionic liquid functionalized graphene oxide loaded nano cobaltosic oxide composite material 河北工业大学 2022-08-23 CN disclosed
CN-109476803-B Amine compositions useful for making polyurethane foams 赢创运营有限公司 2022-04-12 CN disclosed
CN-111261883-A Preparation method and application of ionic liquid functionalized graphene oxide loaded nano cobaltosic oxide composite material 河北工业大学 2020-06-09 CN disclosed
CN-106018519-A Ionic liquid functional composite membrane modified electrode and preparation method and application thereof to detection of chlorophenol 青岛科技大学 2016-10-12 CN disclosed
CN-105845951-A Graphene/stripped hydrotalcite bifunctional oxygen catalyst modified covalently by ionic liquid, preparation method and application thereof 青岛科技大学 2016-08-10 CN disclosed
CN-105784807-A Ionic liquid covalent-modified graphene-hydrotalcite-like composite membrane fixed protein-modified electrode, and preparation method and detection application thereof 青岛科技大学 2016-07-20 CN disclosed