SCHEMBL5693398

SCHEMBL5693398

CC(C)(C)C/C=C(\N)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.32
TET2 Q6N021 1/20 0.31
GRIK1 P39086 1/20 0.31
LDHA P00338 1/20 0.30
LDHB P07195 1/20 0.30
GABRR1 P24046 1/20 0.30

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
SCHEMBL5693412 0.83 MAPK1 (0.32) MAPK1
Chloromethane SCHEMBL7216942 0.73 GRIK1 (0.41) GRIK1LDHALDHBGABRR1
SCHEMBL27577 0.73 CD81 (0.34)
SCHEMBL945032 0.73 CD81 (0.34)
SCHEMBL1284208 0.72
SCHEMBL16130542 0.72
SCHEMBL692111 0.72
SCHEMBL3232704 0.71 MAPK1 (0.39) MAPK1
SCHEMBL3232715 0.71 MAPK1 (0.39) MAPK1
SCHEMBL20598292 0.70

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487882-B1 BASE POLYMER OBTAINED BY HYDROGENATION STOCKHAUSEN CHEM FAB GMBH (DE) 2006-05-24 EP disclosed
US-20050215756-A1 Basic polymer obtained by hydrogenation STOCKHAUSEN GMBH (DE) 2005-09-29 US disclosed
EP-1487882-A1 BASE POLYMER OBTAINED BY HYDROGENATION Stockhausen GmbH (DE) 2004-12-22 EP disclosed
WO-2003080682-A1 BASE POLYMER OBTAINED BY HYDROGENATION STOCKHAUSEN GMBH (DE) 2003-10-02 WO disclosed