SCHEMBL3445442

SCHEMBL3445442

C=Cc1ccccc1OCCCCCN(CC(C)C)CC(C)C

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.47
HTR1B P28222 1/20 0.40
BCHE P06276 2/20 0.39
ACHE P22303 1/20 0.39
MEN1 O00255 1/20 0.39
GAA P10253 1/20 0.39
KMT2A Q03164 1/20 0.39
ATM Q13315 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 4/20 0.37

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
SCHEMBL3445389 1.00 ALDH1A1 (0.47) ALDH1A1HTR1BBCHEACHEMEN1
SCHEMBL3444430 0.99 ALDH1A1 (0.44) ALDH1A1HTR1BBCHEACHEMEN1
SCHEMBL3444287 0.94 SMN1; SMN2 (0.41) ALDH1A1HTR1BBCHEMEN1GAA
SCHEMBL3445001 0.86 MEN1 (0.41) ALDH1A1HTR1BMEN1GAAKMT2A
SCHEMBL3445531 0.84 ALDH1A1 (0.66) ALDH1A1HTR1BBCHEACHE
SCHEMBL3445440 0.84 ALDH1A1 (0.66) ALDH1A1HTR1BBCHEACHE
SCHEMBL3446080 0.84 HTR1B (0.56) ALDH1A1HTR1BKDM4E
SCHEMBL3445650 0.84 HTR1B (0.56) ALDH1A1HTR1BKDM4E
SCHEMBL3445462 0.83 ALDH1A1 (0.52) ALDH1A1HTR1BBCHEACHE
SCHEMBL3446377 0.83 ALDH1A1 (0.52) ALDH1A1HTR1BBCHEACHE

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-7816475-B2 Aminoalkoxystyrene, process for preparation thereof, polymer thereof, process for producing the polymer and use thereof TOSOH CORPORATION (JP) 2010-10-19 US disclosed
EP-1829857-B1 Aminoalkoxystyrene, process for preparation thereof, polymer thereof, process for producing the polymer and use thereof TOSOH CORP (JP) 2009-11-04 EP disclosed
US-20070213490-A1 Aminoalkoxystyrene, process for preparation thereof, polymer thereof, process for producing the polymer and use thereof TOSOH CORPORATION 2007-09-13 US disclosed
EP-1829857-A1 Aminoalkoxystyrene, process for preparation thereof, polymer thereof, process for producing the polymer and use thereof Tosoh Corporation (JP) 2007-09-05 EP disclosed