SCHEMBL6536719

SCHEMBL6536719

CCCCNC(=O)OCCCC.[Ni]

nearest known ligand 0.85

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ACHE P22303 14/20 0.85
EPHX1 P07099 1/20 0.53
EPHX2 P34913 2/20 0.53

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
SCHEMBL3975468 0.98 ACHE (0.88) ACHEEPHX1EPHX2
SCHEMBL19810544 0.96 ACHE (0.85) ACHEEPHX1EPHX2
Ammonia Solution, Strong SCHEMBL9998252 0.96 ACHE (0.85) ACHEEPHX1EPHX2
SCHEMBL2884563 0.96 ACHE (0.85) ACHEEPHX1EPHX2
SCHEMBL2853012 0.96 ACHE (0.85) ACHEEPHX1EPHX2
SCHEMBL10939707 0.94 ACHE (0.81) ACHEEPHX1EPHX2
SCHEMBL7569673 0.94 ACHE (0.81) ACHEEPHX1EPHX2
SCHEMBL20580780 0.92 ACHE (0.79) ACHEEPHX1EPHX2
SCHEMBL10447924 0.92 ACHE (0.85) ACHEEPHX1EPHX2
SCHEMBL7693489 0.92 ACHE (0.78) ACHEEPHX1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115461382-A Metal-based catalyst for the production of polydienes 普利司通美国轮胎运营有限责任公司 2022-12-09 CN disclosed
CN-113906058-A Modified high cis polybutadiene polymers, related methods and rubber compositions 普利司通美国轮胎运营有限责任公司 2022-01-07 CN disclosed
CN-113825777-A Modified high cis polybutadiene polymers, related methods and tire components 株式会社普利司通 2021-12-21 CN disclosed
CN-104356263-B Nickel-based catalyst composition 株式会社普利司通 2020-05-12 CN disclosed
EP-1273935-B1 TRANSPARENT SYNTHETIC RESIN LAMINATE HAVING PHOTOCHROMISM MITSUBISHI GAS CHEMICAL CO (JP) 2004-06-30 EP disclosed
EP-1273935-A1 TRANSPARENT SYNTHETIC RESIN LAMINATE HAVING PHOTOCHROMISM MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2003-01-08 EP disclosed