SCHEMBL4669018

SCHEMBL4669018

CN(CC1(C(OC(N)=O)C(C)(C)C)CC1)c1ccc(Cl)nc1

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
PKM P14618 1/20 0.32
LTC4S Q16873 3/20 0.31
ALDH1A1 P00352 2/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
GAA P10253 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL4670961 0.87 MEN1 (0.32) POLBPKMALDH1A1MEN1KMT2A
SCHEMBL4824088 0.69 MEN1 (0.39) POLBPKMLTC4SALDH1A1MEN1
SCHEMBL4669089 0.68 POLB (0.35) POLBALDH1A1MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL4670894 0.67 POLB (0.34) POLBALDH1A1MEN1KMT2ALMNA
SCHEMBL4824084 0.67 KMT2A (0.38) LTC4SALDH1A1MEN1KMT2ALMNA
SCHEMBL4672795 0.65 MEN1 (0.34) ALDH1A1MEN1KMT2ALMNA
SCHEMBL16586215 0.64 NAPRT (0.44) POLBPKMALDH1A1MEN1KMT2A
SCHEMBL9563445 0.63 NAPRT (0.43) POLBPKMALDH1A1MEN1KMT2A
SCHEMBL5209363 0.62 MAPT (0.40) POLBALDH1A1MEN1KMT2ALMNA
SCHEMBL16586010 0.62 DGAT1 (0.47) POLBPKMALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1757586-B1 POLYSBUSTITUIRTE 1,1-PYRIDINYLAMINOCYCLOPROPANAMIN DERIVATE, VERFAHREN ZU DEREN HERSTELLUNG UND DIESE ENTHALTENDE PHARMATUETISCHE ZUSAMMENSETZUNG SERVIER LAB (FR) 2008-12-03 EP disclosed
EP-1757586-A1 POLYSBUSTITUIRTE 1,1-PYRIDINYLAMINOCYCLOPROPANAMIN DERIVATE, VERFAHREN ZU DEREN HERSTELLUNG UND DIESE ENTHALTENDE PHARMATUETISCHE ZUSAMMENSETZUNG Les Laboratoires Servier (FR) 2007-02-28 EP disclosed