SCHEMBL6172339

SCHEMBL6172339

CN1CCN(c2ccccc2C=C2CN(c3ccc(Cl)cc3)C(C)(C)N2)CC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
NPBWR1 P48145 1/20 0.36
MCHR1 Q99705 1/20 0.36
DRD2 P14416 4/20 0.36
DRD3 P35462 3/20 0.36
ADRA2C P18825 1/20 0.35
POLB P06746 1/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPT P10636 2/20 0.34
ALOX12 P18054 1/20 0.34
DRD4 P21917 3/20 0.34
HTT P42858 2/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
HTR1A P08908 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
KDM4E B2RXH2 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
SCHEMBL5606418 0.77 KMT2A (0.40) KMT2AMEN1NPBWR1MCHR1DRD2
SCHEMBL5606206 0.77 MEN1 (0.47) KMT2AMEN1NPBWR1MCHR1DRD2
SCHEMBL5606207 0.77 MEN1 (0.47) KMT2AMEN1NPBWR1MCHR1DRD2
SCHEMBL27388628 0.75 MEN1 (0.43) KMT2AMEN1NPBWR1MCHR1DRD2
SCHEMBL8519710 0.74 MEN1 (0.42) KMT2AMEN1NPBWR1MCHR1DRD2
SCHEMBL5606898 0.72 MEN1 (0.49) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL5606901 0.72 MEN1 (0.49) KMT2AMEN1POLBALDH1A1MAPT
SCHEMBL8519173 0.70 MEN1 (0.49) KMT2AMEN1NPBWR1MCHR1DRD2
SCHEMBL8519165 0.70 MEN1 (0.49) KMT2AMEN1NPBWR1MCHR1DRD2
SCHEMBL5605981 0.70 KMT2A (0.44) KMT2AMEN1NPBWR1MCHR1DRD2

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-1562908-A1 QUINOLINE DERIVATIVES Pfizer Products Inc. (US) 2005-08-17 EP disclosed
WO-2004043929-A1 QUINOLINE DERIVATIVES PFIZER PRODUCTS INC. (US) 2004-05-27 WO disclosed