SCHEMBL6869261

SCHEMBL6869261

Cc1c(SCCOCCCl)ccnc1CO

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.33

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
SCHEMBL8915962 0.88 MAPK1 (0.36) MAPK1
Hydrochloric Acid SCHEMBL6861431 0.88 MAPK1 (0.34) MAPK1
SCHEMBL8914864 0.88 MAPK1 (0.36) MAPK1
SCHEMBL8914444 0.88 MAPK1 (0.36) MAPK1
SCHEMBL6866383 0.88 MAPK1 (0.36) MAPK1
Hydrochloric Acid SCHEMBL6866392 0.86 MAPK1 (0.36) MAPK1
SCHEMBL8915085 0.86 LMNA (0.33) MAPK1
SCHEMBL6867918 0.82 NPC1 (0.33) MAPK1
SCHEMBL7005383 0.79 ALDH1A1 (0.35) MAPK1
SCHEMBL7011575 0.77 CA2 (0.34)

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-1091957-B1 PYRIMIDIN-AMINOMETHYL-PYRIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE CONTROL OF HELICOBACTER BACTERIA ALTANA PHARMA AG (DE) 2004-12-15 EP disclosed
US-6395732-B1 BACTERICIDES BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2002-05-28 US disclosed
EP-1091957-A1 PYRIMIDIN-AMINOMETHYL-PYRIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE CONTROL OF HELICOBACTER BACTERIA Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2001-04-18 EP disclosed
WO-1999061439-A1 PYRIMIDIN-AMINOMETHYL-PYRIDINE DERIVATIVES, THEIR PREPARATION AND THEIR USE IN THE CONTROL OF HELICOBACTER BACTERIA BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1999-12-02 WO disclosed