SCHEMBL28965190

SCHEMBL28965190

CCCCCN(O)C(=O)Nc1ncnc2[nH]cnc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 4/20 0.40
▸ BRD4 O60885 2/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ HPGD P15428 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HTT P42858 2/20 0.33
▸ NCOA1 Q15788 1/20 0.33
▸ NCOA3 Q9Y6Q9 1/20 0.33
▸ TP53 P04637 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ GFER P55789 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ PTAFR P25105 2/20 0.32

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
SCHEMBL28960558 0.81 CYP1A2 (0.41) XDH
SCHEMBL7052321 0.79 XDH (0.61) XDHBRD4SMN1; SMN2NPC1RAB9A
SCHEMBL5193809 0.79 XDH (0.61) XDHBRD4SMN1; SMN2NPC1RAB9A
SCHEMBL3298679 0.77 EPHX1 (0.52) ALDH1A1HTTEPHX1
SCHEMBL4904307 0.76 EPHX1 (0.46) XDHSMN1; SMN2NPC1RAB9AHTT
Hydrochloric Acid SCHEMBL3413075 0.73 CHEK1 (0.42) XDH
SCHEMBL12145166 0.73 XDH (0.41) XDHBRD4
SCHEMBL536914 0.72 BRAF (0.47) BRD4SMN1; SMN2NPC1RAB9ATP53
SCHEMBL13632472 0.72 ABL1 (0.40) SMN1; SMN2NPC1RAB9ATP53HSD17B10
SCHEMBL3806900 0.72 CCNB2 (0.53) XDHSMN1; SMN2KDM4EALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116064598-B Nucleic acid vaccine for coronavirus 苏州艾博生物科技有限公司 2024-03-12 — — CN disclosed
CN-116615472-A Polymer conjugated lipid compounds and lipid nanoparticle compositions 苏州艾博生物科技有限公司 2023-08-18 — — CN disclosed
CN-116332830-A Lipid compounds and lipid nanoparticle compositions 苏州艾博生物科技有限公司 2023-06-27 — — CN disclosed
CN-116064598-A Nucleic acid vaccine for coronavirus 苏州艾博生物科技有限公司 2023-05-05 — — CN disclosed
CN-115747223-A Nucleic acid compositions of anti-coronavirus antibodies 中国人民解放军军事科学院军事医学研究院 2023-03-07 — — CN disclosed
CN-115724920-A Nucleic acid vaccine for coronavirus and influenza virus 中国人民解放军军事科学院军事医学研究院 2023-03-03 — — CN disclosed
CN-113874507-A Nucleic acid vaccine for coronavirus 苏州艾博生物科技有限公司 2021-12-31 — — CN disclosed
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