SCHEMBL25588401

SCHEMBL25588401

CCCCCCCCCCCCCCCCCCOC(=O)CCn1nnc2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SLC9A1 P19634 5/20 0.64
▸ EGLN3 Q9H6Z9 1/20 0.56
▸ KDM4E B2RXH2 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ PLA2G4A P47712 1/20 0.50
▸ LMNA P02545 3/20 0.49
▸ KMT2A Q03164 3/20 0.49
▸ RAB9A P51151 2/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ MGAM O43451 1/20 0.49
▸ AMY1A P0DUB6 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ SI P14410 1/20 0.49
▸ MGAM2 Q2M2H8 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ HCAR3 P49019 1/20 0.49
▸ MAPK1 P28482 1/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ ASAH1 Q13510 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL28596650 0.88 TP53 (0.59) SLC9A1PLA2G4AKMT2ARAB9AALDH1A1
SCHEMBL15141852 0.85 EGLN3 (0.65) SLC9A1EGLN3KDM4EMAPTLMNA
SCHEMBL5707867 0.84 EGLN3 (0.63) SLC9A1EGLN3KDM4EMAPTLMNA
SCHEMBL12393295 0.81 SLC9A1 (0.63) SLC9A1EGLN3KDM4EMAPTLMNA
SCHEMBL22965243 0.80 SLC9A1 (0.61) SLC9A1EGLN3KDM4EMAPTLMNA
Acetic Acid SCHEMBL28609600 0.80 SLC9A1 (0.83) SLC9A1EGLN3KDM4EMAPTPLA2G4A
SCHEMBL13825807 0.79 SLC9A1 (0.62) SLC9A1EGLN3KDM4EMAPTLMNA
SCHEMBL461412 0.79 SLC9A1 (1.00) SLC9A1EGLN3MAPTLMNAKMT2A
SCHEMBL8406882 0.79 SLC9A1 (1.00) SLC9A1EGLN3MAPTLMNAKMT2A
SCHEMBL535676 0.79 SLC9A1 (1.00) SLC9A1EGLN3MAPTLMNAKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11674105-B2 Azole derivatives as lubricating additives THE LUBRIZOL CORPORATION (US) 2023-06-13 — — US disclosed
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