SCHEMBL1331255

SCHEMBL1331255

CC(C)(C)c1cn(C(C)(C)C)c(C(=O)O)n1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRN P28799 5/20 0.43
SORT1 Q99523 5/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL2450183 0.83 GRN (0.44) GRNSORT1KDM4E
SCHEMBL2608374 0.81 KDM4E (0.33) GRNSORT1KDM4EALDH1A1
SCHEMBL2444703 0.68 NR4A2 (0.38) GRNSORT1KDM4EALDH1A1KMT2A
SCHEMBL17647786 0.66 MEN1 (0.35) GRNSORT1KDM4EALDH1A1MEN1
SCHEMBL11900355 0.65 GRN (0.42) GRNSORT1KDM4EALDH1A1
SCHEMBL24121237 0.65
SCHEMBL24121249 0.65
SCHEMBL28938732 0.64 GRN (0.37) GRNSORT1KDM4E
SCHEMBL4781728 0.62 ALDH1A1 (0.53) KDM4EALDH1A1MEN1KMT2A
SCHEMBL17737477 0.62 ALDH1A1 (0.30) ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115605525-A Uretdione group-containing compositions which crosslink at low temperatures 科思创德国股份有限公司(DE) 2023-01-13 CN disclosed
CN-111094375-B Blocking agent dissociation catalyst for blocked isocyanate and thermosetting composition containing the same 广荣化学株式会社 2022-04-01 CN disclosed
CN-112210288-A Polyurethane powder coating 科思创知识产权两合公司 2021-01-12 CN disclosed
CN-111094375-A Blocking agent dissociation catalyst for blocked isocyanate and thermosetting composition containing the same 广荣化学工业株式会社 2020-05-01 CN disclosed
EP-2765151-B1 Method for the production of polyetherols BASF SE (DE) 2016-10-19 EP disclosed
EP-2765151-A1 Method for the production of polyetherols BASF SE (DE) 2014-08-13 EP disclosed
EP-2569349-B1 METHODS FOR PRODUCING POLYETHEROLS BASF SE (DE) 2014-06-18 EP disclosed
EP-2569349-A1 METHODS FOR PRODUCING POLYETHEROLS BASF SE (DE) 2013-03-20 EP disclosed
WO-2011141492-A1 METHODS FOR PRODUCING POLYETHEROLS BASF SE (DE) 2011-11-17 WO disclosed
US-20110282027-A1 PROCESS FOR PRODUCING POLYETHEROLS BASF SE (DE) 2011-11-17 US disclosed