SCHEMBL8514409

SCHEMBL8514409

CCCCCCCCN(CCCCCCCC)CCc1[nH]nnc1-c1ccc(C)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 1/20 0.40
▸ KCNH2 Q12809 6/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.35
▸ DRD2 P14416 2/20 0.34
▸ OPRM1 P35372 2/20 0.34
▸ DRD3 P35462 2/20 0.34
▸ OPRD1 P41143 2/20 0.34
▸ OPRK1 P41145 2/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ ATP4A P20648 2/20 0.34
▸ ATP4B P51164 2/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ ATM Q13315 1/20 0.33

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
SCHEMBL8514588 1.00 MCHR1 (0.40) MCHR1KCNH2HRH3DRD2OPRM1
SCHEMBL8510293 1.00 MCHR1 (0.40) MCHR1KCNH2HRH3DRD2OPRM1
SCHEMBL8512335 1.00 MCHR1 (0.40) MCHR1KCNH2HRH3DRD2OPRM1
SCHEMBL8510803 1.00 MCHR1 (0.40) MCHR1KCNH2HRH3DRD2OPRM1
SCHEMBL8513001 1.00 MCHR1 (0.40) MCHR1KCNH2HRH3DRD2OPRM1
SCHEMBL8512718 1.00 MCHR1 (0.40) MCHR1KCNH2HRH3DRD2OPRM1
SCHEMBL8515385 0.99 MCHR1 (0.38) MCHR1KCNH2HRH3DRD2OPRM1
SCHEMBL8514982 0.95 ATP4A (0.38) MCHR1KCNH2HRH3ALDH1A1LMNA
SCHEMBL8513626 0.89 ALDH1A1 (0.35) KCNH2HRH3DRD2DRD3ALDH1A1
SCHEMBL3626086 0.88 MCHR1 (0.41) MCHR1KCNH2HRH3ALDH1A1LMNA

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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