SCHEMBL2949936

SCHEMBL2949936

CCCCOC(OCC)C(C)O

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.33
DNM1 Q05193 1/20 0.32
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ADRB2 P07550 1/20 0.32
ADRB1 P08588 1/20 0.32
ADRB3 P13945 1/20 0.32
LPAR1 Q92633 2/20 0.32
LPAR3 Q9UBY5 2/20 0.32
TDP1 Q9NUW8 1/20 0.31
THRB P10828 1/20 0.31
SPHK1 Q9NYA1 1/20 0.31

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
SCHEMBL10956724 0.93 CYP3A4 (0.38) CYP3A4CYP2C9CYP2C19TSHRDNM1
SCHEMBL26641882 0.86 HSD17B10 (0.39) LMNAHSD17B10TDP1THRB
SCHEMBL28329768 0.84 DNM1 (0.47) DNM1LPAR1LPAR3THRBSPHK1
SCHEMBL9546960 0.84 DNM1 (0.47) DNM1LPAR1LPAR3THRBSPHK1
SCHEMBL4312227 0.84 DNM1 (0.47) DNM1LPAR1LPAR3THRBSPHK1
SCHEMBL3147596 0.84 DNM1 (0.47) DNM1LPAR1LPAR3THRBSPHK1
SCHEMBL30535779 0.84 DNM1 (0.47) DNM1LPAR1LPAR3THRBSPHK1
SCHEMBL7249527 0.83 LMNA (0.47) LMNATSHRHSD17B10TDP1THRB
SCHEMBL3108838 0.83 LMNA (0.47) LMNATSHRHSD17B10TDP1THRB
SCHEMBL8735235 0.83 DNM1 (0.45) DNM1LPAR1LPAR3THRBSPHK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1509588-B1 CLEAR RINSE AID WITH PROTECTION AGAINST GLASS CORROSION HENKEL AG & CO KGAA (DE) 2008-06-11 EP claimed
US-5316577-A Metal mixtures with solvents and binders CORNING INCORPORATED (US) 1994-05-31 US claimed
EP-0554715-A2 Plastically deformable metallic mixtures and their use Corning Incorporated (US) 1993-08-11 EP claimed
US-4935579-A SIMPLIFICATION, EFFICIENCY Berg, Lloyd (US) 1990-06-19 US claimed
US-4770794-A Foam fire extinguishing compositions for aerial fire extinguishing WORMALD CANADA INC. (CA) 1988-09-13 US claimed
EP-0009503-A1 TETRACHLOROISOPHTHALONITRILE DISPERSION DIAMOND SHAMROCK CORPORATION (US) 1980-04-16 EP claimed
WO-1979000654-A1 TETRACHLOROISOPHTHALONITRILE DISPERSION DIAMOND SHAMROCK CORP (US) 1979-09-06 WO claimed
US-20240287418-A1 CLEANING COMPOSITION WITH IMPROVED ANTI-GRAY PERFORMANCE AND/OR ANTI-PILLING PERFORMANCE HENKEL AG & CO. KGAA (DE) 2024-08-29 US disclosed
US-20240287417-A1 CLEANING COMPOSITION COMPRISING LIPOLYTIC ENZYME HAVING POLYESTERASE ACTIVITY HENKEL AG & CO. KGAA (DE) 2024-08-29 US disclosed
EP-4414443-A1 CLEANING COMPOSITION COMPRISING POLYESTERASE Henkel AG & Co. KGaA (DE) 2024-08-14 EP disclosed
US-20240240115-A1 COMPOSITION WITH IMPROVED MOISTURE MANAGEMENT PERFORMANCE HENKEL AG & CO. KGAA (DE) 2024-07-18 US disclosed
EP-4363543-A1 COMPOSITION WITH IMPROVED MOISTURE MANAGEMENT PERFORMANCE Henkel AG & Co. KGaA (DE) 2024-05-08 EP disclosed
EP-4363542-A1 CLEANING COMPOSITION COMPRISING LIPOLYTIC ENZYME HAVING POLYESTERASE ACTIVITY Henkel AG & Co. KGaA (DE) 2024-05-08 EP disclosed
EP-0216047-A1 Process for producing organophilic silica THE SHERWIN-WILLIAMS COMPANY (US) 1987-04-01 EP disclosed
US-4644077-A Process for producing organophilic silica THE SHERWIN-WILLIAMS COMPANY (US) 1987-02-17 US disclosed
US-4525245-A WITH AT LEAST DMSO BERG LLOYD 1985-06-25 US disclosed
EP-0034126-B1 COSMETIC AND DERMATOLOGICAL COMPOSITIONS FOR SHAVING THE SKIN Maggesi, Luigi (IT) 1984-07-04 EP disclosed
EP-0034126-A1 Cosmetic and dermatological compositions for shaving the skin Maggesi, Luigi (IT) 1981-08-19 EP disclosed
EP-0009503-A1 TETRACHLOROISOPHTHALONITRILE DISPERSION DIAMOND SHAMROCK CORPORATION (US) 1980-04-16 EP disclosed
WO-1979000654-A1 TETRACHLOROISOPHTHALONITRILE DISPERSION DIAMOND SHAMROCK CORP (US) 1979-09-06 WO disclosed