SCHEMBL4359013

SCHEMBL4359013

C=Cc1cccc(OCCCCCN(C(C)C)C(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.42
CHRNA4 P43681 1/20 0.42
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 2/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAOB P27338 7/20 0.40
MAOA P21397 5/20 0.40
LTA4H P09960 1/20 0.39
TLR4 O00206 1/20 0.39
TLR2 O60603 1/20 0.39
TSHR P16473 2/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 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
SCHEMBL3445339 1.00 CHRNB2 (0.42) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL3444839 0.99 CHRNB2 (0.43) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL3444150 0.94 CHRNB2 (0.43) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL3446671 0.88 KDM4E (0.39) KDM4EALDH1A1LMNASMN1; SMN2MAOB
SCHEMBL3446076 0.88 KDM4E (0.39) KDM4EALDH1A1LMNASMN1; SMN2MAOB
SCHEMBL3446357 0.87 KDM4E (0.40) KDM4EALDH1A1LMNASMN1; SMN2MAOB
SCHEMBL3446097 0.85 ALDH1A1 (0.52) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL3445666 0.85 ALDH1A1 (0.52) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL3445801 0.84 KDM4E (0.45) CHRNB2CHRNA4KDM4EALDH1A1LMNA
SCHEMBL3444116 0.84 KDM4E (0.45) CHRNB2CHRNA4KDM4EALDH1A1LMNA

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-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
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