SCHEMBL9167701

SCHEMBL9167701

CCCCC(CC)C(=O)OCCOCCOCCOCCO

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.56
CA1 P00915 4/20 0.56
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MAPK1 P28482 2/20 0.47
THRB P10828 1/20 0.47
HTT P42858 1/20 0.47
MAPT P10636 1/20 0.47
TSHR P16473 1/20 0.47
EPHX2 P34913 1/20 0.39
GAA P10253 1/20 0.38
XBP1 P17861 1/20 0.38
ATM Q13315 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ACHE P22303 1/20 0.38
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL17626978 1.00 CA2 (0.56) CA2CA1MEN1KMT2AMAPK1
SCHEMBL8985885 1.00 CA2 (0.56) CA2CA1MEN1KMT2AMAPK1
SCHEMBL474747 1.00 CA2 (0.56) CA2CA1MEN1KMT2AMAPK1
SCHEMBL9167509 0.95 CA2 (0.50) CA2CA1MEN1KMT2AMAPK1
SCHEMBL9169005 0.95 CA2 (0.50) CA2CA1MEN1KMT2AMAPK1
SCHEMBL9075242 0.93 MEN1 (0.50) CA2CA1MEN1KMT2AMAPK1
SCHEMBL80087 0.93 CA2 (0.63) CA2CA1MAPK1TSHRGAA
SCHEMBL32980 0.93 CA2 (0.63) CA2CA1MAPK1TSHRGAA
SCHEMBL8346686 0.93 CA2 (0.63) CA2CA1MAPK1TSHRGAA
SCHEMBL8349420 0.93 CA2 (0.63) CA2CA1MAPK1TSHRGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105837876-A Nitrile rubber sealing gasket for aviation hydraulic fluid sealing and preparation method of nitrile rubber sealing gasket 安徽精机械设备有限公司 2016-08-10 CN claimed
US-4728588-A Secondary battery THE DOW CHEMICAL COMPANY (US) 1988-03-01 US claimed
CN-109071994-A The product for being subjected to ice formation including the rejection surface comprising fluorochemical materials 3M创新有限公司 2018-12-21 CN disclosed
US-10029448-B2 Laminate KURARAY CO., LTD. (JP) 2018-07-24 US disclosed
CN-105837876-A Nitrile rubber sealing gasket for aviation hydraulic fluid sealing and preparation method of nitrile rubber sealing gasket 安徽精机械设备有限公司 2016-08-10 CN disclosed
US-20160167349-A1 LAMINATE KURARAY CO., LTD, (JP) 2016-06-16 US disclosed
EP-3000600-A1 LAMINATE Kuraray Co., Ltd. (JP) 2016-03-30 EP disclosed
EP-2150247-B1 POLYETHYLENE GLYCOL ESTERS AND COSMETIC AND/OR DERMATOLOGICAL PREPARATIONS SYMRISE AG (DE) 2012-10-31 EP disclosed
US-5425869-A Polymeric film-based electrochemical sensor apparatus THE DOW CHEMICAL COMPANY (US) 1995-06-20 US disclosed
EP-0637382-A1 POLYMERIC FILM-BASED ELECTROCHEMICAL SENSOR APPARATUS THE DOW CHEMICAL COMPANY (a Delaware corporation) (US) 1995-02-08 EP disclosed
WO-1993021522-A1 POLYMERIC FILM-BASED ELECTROCHEMICAL SENSOR APPARATUS THE DOW CHEMICAL COMPANY (US) 1993-10-28 WO disclosed
US-5057565-A Solid polyelectrolyte polymer film THE DOW CHEMICAL COMPANY (US) 1991-10-15 US disclosed
EP-0293946-A2 Secondary battery THE DOW CHEMICAL COMPANY (US) 1988-12-07 EP disclosed
US-4728588-A Secondary battery THE DOW CHEMICAL COMPANY (US) 1988-03-01 US disclosed
US-3974080-A PHOSPHORIC ACID ESTER UNION CARBIDE CORPORATION (US) 1976-08-10 US disclosed