SCHEMBL3444178

SCHEMBL3444178

C=Cc1cccc(OCCCN(CCCC)C(C)C)c1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TLR4 O00206 1/20 0.45
TLR2 O60603 1/20 0.45
TSHR P16473 2/20 0.40
KDM4E B2RXH2 1/20 0.39
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
AHR P35869 1/20 0.38
BCHE P06276 2/20 0.38
ACHE P22303 2/20 0.38
THRA P10827 1/20 0.37
THRB P10828 1/20 0.37
KMT2A Q03164 1/20 0.36

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
SCHEMBL3445058 0.95 TLR4 (0.42) TLR4TLR2TSHRKDM4EMAOA
SCHEMBL4543255 0.93 MAOA (0.42) TLR4TLR2TSHRKDM4EMAOA
SCHEMBL3445705 0.87 TLR4 (0.49) TLR4TLR2TSHRKDM4EMAOA
SCHEMBL3446644 0.86 TLR4 (0.41) TLR4TLR2TSHRKDM4EMAOA
SCHEMBL3445731 0.84 TLR4 (0.47) TLR4TLR2TSHRMAOAMAOB
SCHEMBL3444150 0.84 CHRNB2 (0.43) TLR4TLR2TSHRKDM4EMAOA
SCHEMBL3445694 0.84 CHRNB2 (0.49) KDM4EMAOAMAOBAHRBCHE
SCHEMBL412094 0.83 TLR4 (0.60) TLR4TLR2TSHRAHRTHRB
SCHEMBL3445153 0.83 BCHE (0.49) TLR4TLR2TSHRMAOAMAOB
SCHEMBL2623207 0.82 TSHR (0.57) TLR4TLR2TSHRTHRATHRB

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