SCHEMBL10320909

SCHEMBL10320909

CCCCCCCCCN=Cc1ccccn1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.56
CYP2C19 P33261 1/20 0.56
NR4A1 P22736 1/20 0.46
MAOA P21397 2/20 0.45
TOP2A P11388 2/20 0.43
LMNA P02545 3/20 0.43
KDM4E B2RXH2 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
USP2 O75604 2/20 0.43
ALOX15 P16050 1/20 0.43
ALOX12 P18054 1/20 0.43
HTT P42858 1/20 0.43
HSP90AA1 P07900 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ATM Q13315 1/20 0.42
G6PC1 P35575 1/20 0.42
ALDH1A1 P00352 1/20 0.41

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
SCHEMBL10321703 1.00 CYP1A2 (0.56) CYP1A2CYP2C19NR4A1MAOATOP2A
SCHEMBL16353929 1.00 CYP1A2 (0.56) CYP1A2CYP2C19NR4A1MAOATOP2A
SCHEMBL10321597 1.00 CYP1A2 (0.56) CYP1A2CYP2C19NR4A1MAOATOP2A
SCHEMBL27112153 1.00 CYP1A2 (0.56) CYP1A2CYP2C19NR4A1MAOATOP2A
SCHEMBL16353859 1.00 CYP1A2 (0.56) CYP1A2CYP2C19NR4A1MAOATOP2A
SCHEMBL342149 1.00 CYP1A2 (0.56) CYP1A2CYP2C19NR4A1MAOATOP2A
SCHEMBL10321022 1.00 CYP1A2 (0.56) CYP1A2CYP2C19NR4A1MAOATOP2A
SCHEMBL139351 1.00 CYP1A2 (0.56) CYP1A2CYP2C19NR4A1MAOATOP2A
SCHEMBL16353930 1.00 CYP1A2 (0.56) CYP1A2CYP2C19NR4A1MAOATOP2A
SCHEMBL832504 0.98 CYP1A2 (0.53) CYP1A2CYP2C19NR4A1MAOATOP2A

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-20170044392-A1 POLYMER COATING COMPRISING 2-METHOXYETHYL ACRYLATE UNITS SYNTHESIZED BY SURFACE-INITIATED ATOM TRANSFER RADICAL POLYMERIZATION UNIV DENMARK TECH DTU (DK) 2017-02-16 US disclosed
US-9346971-B2 Polymer coating comprising 2-methoxyethyl acrylate units synthesized by surface-initiated atom transfer radical polymerization TECHNICAL UNIVERSITY OF DENMARK (DK) 2016-05-24 US disclosed
EP-2453942-B1 POLYMER COATING COMPRISING 2-METHOXYETHYL ACRYLATE UNITS SYNTHESIZED BY SURFACE-INITIATED ATOM TRANSFER RADICAL POLYMERIZATION UNIV DENMARK TECH DTU (DK) 2014-08-13 EP disclosed
US-20120184029-A1 POLYMER COATING COMPRISING 2- METHOXYETHYL ACRYLATE UNITS SYNTHESIZED BY SURFACE-INITIATED ATOM TRANSFER RADICAL POLYMERIZATION TECHNICAL UNIVERSITY OF DENMARK (DK) 2012-07-19 US disclosed