SCHEMBL8511414

SCHEMBL8511414

CCCCCN(CCCCC)Cc1[nH]nnc1-c1ccccc1C

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 3/20 0.34
▸ AGTR2 P50052 3/20 0.34
▸ KCNH2 Q12809 4/20 0.34
▸ TLR8 Q9NR97 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ NMT2 O60551 1/20 0.33
▸ NMT1 P30419 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33
▸ ICMT O60725 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MEN1 O00255 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ DCUN1D1 Q96GG9 1/20 0.31
▸ HTR7 P34969 1/20 0.31
▸ MAPK8 P45983 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
SCHEMBL8510714 0.99 KCNH2 (0.36) AGTR1AGTR2KCNH2TLR8GAA
SCHEMBL3626087 0.99 KCNH2 (0.36) AGTR1AGTR2KCNH2TLR8GAA
SCHEMBL8513368 0.99 KCNH2 (0.36) AGTR1AGTR2KCNH2TLR8GAA
SCHEMBL8512972 0.99 KCNH2 (0.36) AGTR1AGTR2KCNH2TLR8GAA
SCHEMBL8510207 0.99 KCNH2 (0.36) AGTR1AGTR2KCNH2TLR8GAA
SCHEMBL8510303 0.99 KCNH2 (0.36) AGTR1AGTR2KCNH2TLR8GAA
SCHEMBL8512057 0.99 KCNH2 (0.36) AGTR1AGTR2KCNH2TLR8GAA
SCHEMBL8514514 0.96 AGTR1 (0.36) AGTR1AGTR2TLR8GAANMT2
SCHEMBL8513162 0.91 GAA (0.36) AGTR1AGTR2GAANMT2NMT1
SCHEMBL8515386 0.89 DRD2 (0.37) AGTR1AGTR2KCNH2TLR8GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2471896-B1 REFRIGERANT OIL FOR FREEZERS AND OPERATING FLUID COMPOSITION FOR FREEZERS JX NIPPON OIL & ENERGY CORP (JP) 2017-05-24 — — EP disclosed
US-9090806-B2 Refrigerant oil for freezers and operating fluid composition for freezers JX NIPPON OIL & ENERGY CORPORATION (JP) 2015-07-28 — — US disclosed
US-8889031-B2 Working fluid composition for refrigerator machine and refrigerating machine oil JX NIPPON OIL & ENERGY CORPORATION (JP) 2014-11-18 — — US disclosed
EP-2740784-A1 Refrigerant oil for freezers and operating fluid composition for freezers JX Nippon Oil & Energy Corporation (JP) 2014-06-11 — — EP disclosed
EP-2733192-A1 Refrigerant oil for freezers and operating fluid composition for freezers JX Nippon Oil & Energy Corporation (JP) 2014-05-21 — — EP disclosed
US-20120228541-A1 REFRIGERANT OIL FOR FREEZERS AND OPERATING FLUID COMPOSITION FOR FREEZERS JX NIPPON OIL & ENERGY CORPORATION (JP) 2012-09-13 — — US disclosed
EP-2471896-A1 REFRIGERANT OIL FOR FREEZERS AND OPERATING FLUID COMPOSITION FOR FREEZERS JX Nippon Oil & Energy Corporation (JP) 2012-07-04 — — EP disclosed
US-20120132848-A1 WORKING FLUID COMPOSITION FOR REFRIGERATOR MACHINE AND REFRIGERATING MACHINE OIL JX NIPPON OIL & ENERGY CORPORATION (JP) 2012-05-31 — — US disclosed
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