SCHEMBL3765880

SCHEMBL3765880

CC(C)CC(C)OC(=O)CCCCC(=O)OC(C)CC(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.52
CYP19A1 P11511 1/20 0.46
MAPT P10636 3/20 0.44
MAPK1 P28482 2/20 0.44
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.39
EPHX2 P34913 3/20 0.38
PRKCA P17252 1/20 0.38
PRKCE Q02156 1/20 0.38
PRKCQ Q04759 1/20 0.38
PRKCD Q05655 1/20 0.38
CYP1A2 P05177 1/20 0.36
DGKA P23743 1/20 0.35
MEN1 O00255 1/20 0.35
GMNN O75496 1/20 0.35
HSP90AA1 P07900 1/20 0.35
BLM P54132 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NR1H4 Q96RI1 1/20 0.35

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
SCHEMBL10403448 0.98 LMNA (0.55) LMNACYP19A1MAPTMAPK1ALDH1A1
SCHEMBL491457 0.95 LMNA (0.47) LMNACYP19A1MAPTMAPK1ALDH1A1
SCHEMBL8419684 0.92 LMNA (0.66) LMNAMAPTMAPK1ALDH1A1TSHR
SCHEMBL6652791 0.92 TSHR (0.47) LMNACYP19A1ALDH1A1TSHRMEN1
SCHEMBL9885357 0.90 CYP19A1 (0.48) LMNACYP19A1TSHR
SCHEMBL10456217 0.90 LMNA (0.69) LMNAMAPTMAPK1ALDH1A1TSHR
SCHEMBL23754243 0.89 LMNA (0.42) LMNACYP19A1MAPTMAPK1ALDH1A1
SCHEMBL22248495 0.89 LMNA (0.57) LMNACYP19A1MAPTMAPK1ALDH1A1
SCHEMBL9622733 0.88 LMNA (0.47) LMNACYP19A1MAPTMAPK1ALDH1A1
SCHEMBL28795594 0.87 TSHR (0.52) LMNACYP19A1TSHR

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1064082-B1 CONTAMINANT DISPERSANTS USEFUL IN RECYCLING OF TREATED CONTAINERS NALCO CO (US) 2004-06-02 EP claimed
US-6113738-A ADDING PLASTICIZER SELECTED FROM ADIPIC ACID, DIMETHYL ADIPATE, DIETHYL ADIPATE, DIISOBUTYL ADIPATE AND OTHER ESTERS OF ADIPIC ACID; DISPERSING TO OBTAIN TREATED FIBER; SEPARATING TREATED FIBER FROM SLURRY CONTAINING WAX; RECOVERING FIBER NALCO CHEMICAL COMPANY (US) 2000-09-05 US claimed
US-8207098-B2 Lubricant additive, lubricant composition and grease composition YAMANASHI UNIVERSITY (JP) 2012-06-26 US disclosed
WO-2007018394-A9 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG CHEM, LTD. (KR) 2010-12-02 WO disclosed
US-20090239773-A1 LUBRICANT ADDITIVE, LUBRICANT COMPOSITION AND GREASE COMPOSITION YAMANASHI UNIVERSITY (JP) 2009-09-24 US disclosed
EP-1913081-A1 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG Chem. Ltd. (KR) 2008-04-23 EP disclosed
WO-2007018394-A1 HIGHLY ELASTIC POLYVINYL CHLORIDE COMPOSITION AND PRODUCTS PREPARED USING THE SAME LG CHEM, LTD. (KR) 2007-02-15 WO disclosed
US-20070037929-A1 Highly elastic polyvinyl chloride composition and products prepared using the same LG CHEM, LTD (KR) 2007-02-15 US disclosed
EP-1064082-B1 CONTAMINANT DISPERSANTS USEFUL IN RECYCLING OF TREATED CONTAINERS NALCO CO (US) 2004-06-02 EP disclosed
US-6548558-B2 Reuse of paper, paperboard ONDEO NALCO COMPANY 2003-04-15 US disclosed
US-20010041749-A1 Contaminant dispersants useful in recycling of treated containers ECOLAB USA INC. 2001-11-15 US disclosed
EP-1064082-A4 CONTAMINANT DISPERSANTS USEFUL IN RECYCLING OF TREATED CONTAINERS NALCO CHEMICAL CO (US) 2001-04-11 EP disclosed
EP-1064082-A1 CONTAMINANT DISPERSANTS USEFUL IN RECYCLING OF TREATED CONTAINERS NALCO CHEMICAL COMPANY (US) 2001-01-03 EP disclosed
US-6113738-A ADDING PLASTICIZER SELECTED FROM ADIPIC ACID, DIMETHYL ADIPATE, DIETHYL ADIPATE, DIISOBUTYL ADIPATE AND OTHER ESTERS OF ADIPIC ACID; DISPERSING TO OBTAIN TREATED FIBER; SEPARATING TREATED FIBER FROM SLURRY CONTAINING WAX; RECOVERING FIBER NALCO CHEMICAL COMPANY (US) 2000-09-05 US disclosed
WO-1999047248-A1 CONTAMINANT DISPERSANTS USEFUL IN RECYCLING OF TREATED CONTAINERS NALCO CHEMICAL COMPANY (US) 1999-09-23 WO disclosed
EP-0578435-B1 Friction modification of synthetic gear oils ETHYL PETROLEUM ADDITIVES LTD (GB) 1997-10-15 EP disclosed
EP-0767236-A1 Friction modification of synthetic gear oils ETHYL PETROLEUM ADDITIVES LIMITED (GB) 1997-04-09 EP disclosed
EP-0578435-A1 Friction modification of synthetic gear oils ETHYL PETROLEUM ADDITIVES LIMITED (GB) 1994-01-12 EP disclosed
US-4968453-A FOR AUTOMOBILE SUPERCHARGER TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 1990-11-06 US disclosed
US-4719025-A WEAR RESISTANCE, DIESTER, POLYETHER TOYOTA JIDOSHA KABUSHIKI KAISHA (JP) 1988-01-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090239773-A1 LUBRICANT ADDITIVE, LUBRICANT COMPOSITION AND GREASE COMPOSITION GRN, GRIA1, GRIK5 LMNA 3546/4885CYP19A1 3495/4885MAPT 2509/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.