SCHEMBL7879429

SCHEMBL7879429

CCCCCC(C)(C)c1ccc(OCC(C)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.47
▸ HSD17B10 Q99714 1/20 0.46
▸ CNR2 P34972 16/20 0.46
▸ CNR1 P21554 7/20 0.46
▸ HTT P42858 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ PLA2G4B P0C869 1/20 0.41

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
SCHEMBL2108186 0.86 CNR2 (0.49) LMNAHSD17B10CNR2CNR1
SCHEMBL2108648 0.85 HTT (0.48) LMNAHSD17B10CNR2CNR1HTT
SCHEMBL28000798 0.83 LMNA (0.55) LMNAHTTHIF1A
SCHEMBL10492948 0.81 NR5A1 (0.53) CNR2CNR1
SCHEMBL10513794 0.80 NR5A1 (0.56) CNR2CNR1
SCHEMBL9636030 0.79 MAPK1 (0.55) LMNAHSD17B10CNR2CNR1HTT
SCHEMBL28922466 0.79 LMNA (0.62) LMNAHIF1APLA2G4B
SCHEMBL2108030 0.79 CYP3A4 (0.54) CNR2CNR1
SCHEMBL4074135 0.79 CYP3A4 (0.62) LMNACNR2CNR1
SCHEMBL4071970 0.79 LMNA (0.44) LMNAHSD17B10CNR2CNR1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6322702-B1 DISSOLVING FLUORINATED ALCOHOLS IN AN SOLVENT, REACTING WITH A AQUEOUS ALKALINE SOLUTION FORMING AN HYDROXIDE-DEPLETED AQUEOUS PHASE AND A FLUORINATED ALKOXIDE-CONTAINING RECOVERY PHASE AND SEPARATING THE TWO U.T. BATTLLE, LLC 2001-11-27 — — US claimed
US-6174503-B1 NUCLEAR WASTES TREATMENT, ESPECIALLY WASTES WITH A HIGH CONCENTRATION OF COMPETING ALKALI METAL CATIONS LOCKHEED MARTIN ENERGY RESEARCH CORPORATION 2001-01-16 — — US claimed
WO-1999012878-A1 SOLVENT AND PROCESS FOR EXTRACTING CESIUM FROM ALKALINE WASTE SOLUTIONS LOCKHEED MARTIN ENERGY RES COR (US) 1999-03-18 — — WO claimed
US-6174503-B1 NUCLEAR WASTES TREATMENT, ESPECIALLY WASTES WITH A HIGH CONCENTRATION OF COMPETING ALKALI METAL CATIONS LOCKHEED MARTIN ENERGY RESEARCH CORPORATION 2001-01-16 — — US disclosed
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