SCHEMBL1498685

SCHEMBL1498685

Nc1ccc(Nc2ccccc2)c(C2CCCCC2)c1C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 0.44
GAA P10253 9/20 0.44
KDM4E B2RXH2 9/20 0.44
ALDH1A1 P00352 6/20 0.44
MEN1 O00255 6/20 0.44
KMT2A Q03164 6/20 0.44
LMNA P02545 4/20 0.44
CYP1A2 P05177 2/20 0.44
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
CYP2D6 P10635 1/20 0.44
PDE5A O76074 1/20 0.40
GFER P55789 3/20 0.40
TDP1 Q9NUW8 3/20 0.39
HTT P42858 3/20 0.39
ALOX15 P16050 2/20 0.39
HPGD P15428 4/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HSD17B10 Q99714 2/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL3692132 0.77 TDO2 (0.38) MAPTGAAKDM4EALDH1A1LMNA
SCHEMBL4482096 0.77 TDO2 (0.38) MAPTGAAKDM4EALDH1A1LMNA
SCHEMBL247757 0.77 TDO2 (0.38) MAPTGAAKDM4EALDH1A1LMNA
SCHEMBL28273169 0.77 KDM4E (0.36) MAPTGAAKDM4EALDH1A1ALOX15
SCHEMBL1498644 0.75 PDE5A (0.38) MAPTGAAKDM4EALDH1A1MEN1
SCHEMBL1498733 0.74 KDM4E (0.34) MAPTGAAKDM4EALOX15HDAC3
SCHEMBL3963851 0.74 GAA (0.53) MAPTGAAKDM4EALDH1A1MEN1
SCHEMBL3688474 0.73 ALOX15 (0.37) MAPTGAAKDM4EALDH1A1LMNA
SCHEMBL1498651 0.73 KCNH3 (0.46) ALDH1A1MEN1KMT2ALMNAHTT
SCHEMBL990901 0.72 MAPT (0.47) MAPTGAAKDM4EALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2011506452-A 2011-03-03 JP claimed
EP-2240559-A2 CYCLOALKYL PHENYLENEDIAMINES AS DEPOSIT CONTROL AGENTS FOR LUBRICANTS Chemtura Corporation (US) 2010-10-20 EP claimed
WO-2009076090-A2 CYCLOALKYL PHENYLENEDIAMINES AS DEPOSIT CONTROL AGENTS FOR LUBRICANTS CHEMTURA CORPORATION (US) 2009-06-18 WO claimed
EP-2240559-A2 CYCLOALKYL PHENYLENEDIAMINES AS DEPOSIT CONTROL AGENTS FOR LUBRICANTS Chemtura Corporation (US) 2010-10-20 EP disclosed
WO-2009076090-A2 CYCLOALKYL PHENYLENEDIAMINES AS DEPOSIT CONTROL AGENTS FOR LUBRICANTS CHEMTURA CORPORATION (US) 2009-06-18 WO disclosed