SCHEMBL5584313

SCHEMBL5584313

CO[Si](CCC(F)(F)F)(OC)N1CCCCC1c1cccc(C)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.37
ALDH1A1 P00352 5/20 0.36
MAOA P21397 1/20 0.35
DRD2 P14416 1/20 0.35
DRD1 P21728 1/20 0.35
DRD4 P21917 1/20 0.35
DRD5 P21918 1/20 0.35
DRD3 P35462 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.34
ROCK2 O75116 1/20 0.34
KDM4E B2RXH2 3/20 0.33
HTR2C P28335 2/20 0.33
RIPK1 Q13546 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 2/20 0.33
RAB9A P51151 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
SCHEMBL5584258 0.97 ALDH1A1 (0.39) MAOBALDH1A1MAOADRD2DRD1
SCHEMBL5584140 0.70
SCHEMBL5584404 0.70 PEPD (0.30)
SCHEMBL137670 0.70 KMT2A (0.32) ALDH1A1MAPK1
SCHEMBL14948763 0.67 CHRNB2 (0.59) MAOBALDH1A1DRD2DRD1DRD4
SCHEMBL5584096 0.66 PEPD (0.31)
SCHEMBL22055802 0.65 ALDH1A1 (0.48) MAOBALDH1A1MAOADRD2DRD1
SCHEMBL6559996 0.64 RIPK1 (0.46) MAOBMAOADRD2DRD4DRD3
SCHEMBL9171843 0.64
SCHEMBL13162103 0.63 CHRNB2 (0.66) ALDH1A1LMNAMAPT

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
US-20070039732-A1 Methods and compositions for improving hydrocarbon recovery by water flood intervention BJ SERVICES COMPANY 2007-02-22 US disclosed
EP-0926164-B1 Substituted amino silane compounds and catalyst for the polymerization of alpha-olefins containing them BASELL NORTH AMERICA INC (US) 2004-02-25 EP disclosed
US-6130180-A Catalyst for the polymerization of alpha-olefins containing substituted amino silane compounds MONTELL NORTH AMERICA INC. (US) 2000-10-10 US disclosed
EP-0926164-A2 Substituted amino silane compounds and catalyst for the polymerization of alpha-olefins containing them MONTELL NORTH AMERICA INC. (US) 1999-06-30 EP disclosed