SCHEMBL6560508

SCHEMBL6560508

CCCCc1cc(CCCC)c(C)c(CCCC)c1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.54
NPC1 O15118 1/20 0.54
MAPK1 P28482 1/20 0.54
HTT P42858 1/20 0.54
RAB9A P51151 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
PTGS2 P35354 4/20 0.45
CYP3A4 P08684 1/20 0.45
SKP2 Q13309 1/20 0.44
TYR P14679 2/20 0.41
GPR84 Q9NQS5 2/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
TLR8 Q9NR97 1/20 0.37
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL1671839 0.91 PTGS2 (0.55) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL692706 0.91 PTGS2 (0.55) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL11355625 0.80 HTT (0.37) HPGDNPC1MAPK1HTTRAB9A
Toluene SCHEMBL250483 0.80 KCNH2 (0.45) MAPK1HTTNPSR1PTGS2CYP3A4
Toluene SCHEMBL571314 0.80 KCNH2 (0.45) MAPK1HTTNPSR1PTGS2CYP3A4
SCHEMBL201691 0.79 HPGD (0.47) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL62286 0.79 TYR (0.53) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL20779039 0.79 HPGD (0.47) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL7203143 0.79 HPGD (0.47) HPGDNPC1MAPK1HTTRAB9A
SCHEMBL15063742 0.79 NPC1 (0.47) HPGDNPC1MAPK1HTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119534424-A Method for testing content of phosphorus pentafluoride 河南省氟基新材料科技有限公司 2025-02-28 CN disclosed
CN-115784182-B Preparation method of phosphorus pentafluoride 福建省龙德新能源有限公司 2024-01-19 CN disclosed
CN-115970465-B Absorption tower for purifying phosphorus pentafluoride 福建省龙德新能源有限公司 2023-10-27 CN disclosed
WO-2016161202-A1 AROMATIC ALKYLATION USING HALOMETALLATE IONIC LIQUID MICRO-EMULSIONS UOP LLC (US) 2016-10-06 WO disclosed
EP-0991613-B1 OLEFIN SKELETAL ISOMERIZATION PROCESS CATALYTIC DISTILLATION TECH (US) 2004-03-24 EP disclosed
US-5811623-A CONVERTING LINEAR OLEFINS TO BRANCHED OLEFINS AND SEPARATING OLEFINS FROM PARAFFINS CATALYTIC DISTILLATION TECHNOLOGIES (US) 1998-09-22 US disclosed
US-4297508-A BY REACTING CARBON DIOXIDE WITH B-NAPHTHOL, AN ALKALI METAL SALT OF B-NAPHTHOL, AND AN ALKYLBENZENE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-10-27 US disclosed