SCHEMBL3688474

SCHEMBL3688474

CCNc1ccc(N)c(C2CCCCCCC2)c1C1CCCCCCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.37
KDM4E B2RXH2 2/20 0.36
GAA P10253 2/20 0.36
MAPT P10636 2/20 0.36
ALDH1A1 P00352 1/20 0.36
THRB P10828 1/20 0.36
HPGD P15428 1/20 0.36
HTT P42858 1/20 0.36
GFER P55789 1/20 0.36
PLEC Q15149 1/20 0.36
LMNA P02545 1/20 0.33
NOS3 P29474 2/20 0.33
NOS1 P29475 2/20 0.33
NOS2 P35228 2/20 0.33
PDE4B Q07343 1/20 0.33
PDE4D Q08499 1/20 0.33
AAK1 Q2M2I8 1/20 0.31
ADK P55263 1/20 0.31
IDO1 P14902 1/20 0.30
CTSK P43235 3/20 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
SCHEMBL1498815 0.85 TLR8 (0.37) ALOX15MAPTCNR1CNR2
SCHEMBL1498738 0.83 IDO1 (0.35) ALOX15KDM4EGAAMAPTALDH1A1
SCHEMBL1498710 0.83 CNR1 (0.38) ALDH1A1LMNACNR1CNR2
SCHEMBL28273169 0.81 KDM4E (0.36) ALOX15KDM4EGAAMAPTALDH1A1
SCHEMBL1498733 0.79 KDM4E (0.34) ALOX15KDM4EGAAMAPTADK
SCHEMBL3692132 0.78 TDO2 (0.38) KDM4EGAAMAPTALDH1A1GFER
SCHEMBL4482096 0.78 TDO2 (0.38) KDM4EGAAMAPTALDH1A1GFER
SCHEMBL247757 0.78 TDO2 (0.38) KDM4EGAAMAPTALDH1A1GFER
SCHEMBL3698113 0.75 ALOX15 (0.32) ALOX15ALDH1A1
SCHEMBL1498685 0.73 MAPT (0.44) ALOX15KDM4EGAAMAPTALDH1A1

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-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