SCHEMBL8513628

SCHEMBL8513628

CCCN(CCC)CCc1[nH]nnc1-c1ccccc1C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR1A P08908 2/20 0.37
▸ GAA P10253 1/20 0.35
▸ DRD3 P35462 3/20 0.33
▸ DRD2 P14416 2/20 0.33
▸ HTR2A P28223 2/20 0.33
▸ HTR7 P34969 2/20 0.33
▸ HTR1D P28221 1/20 0.33
▸ HTR1B P28222 1/20 0.33
▸ HTR2B P41595 1/20 0.33
▸ HTR5A P47898 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ OPRD1 P41143 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ DRD1 P21728 1/20 0.33
▸ DRD4 P21917 1/20 0.33
▸ DRD5 P21918 1/20 0.33
▸ DCUN1D1 Q96GG9 1/20 0.33
▸ NMT2 O60551 1/20 0.32
▸ NMT1 P30419 1/20 0.32
▸ NPC1 O15118 1/20 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
SCHEMBL8514983 0.92 DRD2 (0.36) GAADRD3DRD2OPRM1OPRD1
SCHEMBL8515386 0.91 DRD2 (0.37) GAADRD3DRD2OPRM1OPRD1
SCHEMBL284040 0.90 GAA (0.36) HTR1AGAAHTR2AHTR7HTR1D
SCHEMBL8510807 0.90 DRD2 (0.38) GAADRD3DRD2OPRM1OPRD1
SCHEMBL8510296 0.90 DRD2 (0.38) GAADRD3DRD2OPRM1OPRD1
SCHEMBL8514593 0.90 DRD2 (0.38) GAADRD3DRD2OPRM1OPRD1
SCHEMBL8512340 0.90 DRD2 (0.38) GAADRD3DRD2OPRM1OPRD1
SCHEMBL8512720 0.90 DRD2 (0.38) GAADRD3DRD2OPRM1OPRD1
SCHEMBL8513004 0.90 DRD2 (0.38) GAADRD3DRD2OPRM1OPRD1
SCHEMBL8514413 0.90 DRD2 (0.38) GAADRD3DRD2OPRM1OPRD1

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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