SCHEMBL16799229

SCHEMBL16799229

C=C(C)C(=O)NCCCNC(=O)CCCCCCCC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA1A P35348 1/20 0.53
▸ EPHX2 P34913 4/20 0.51
▸ PLA2G2A P14555 2/20 0.49
▸ PLA2G4A P47712 1/20 0.49
▸ KDM4E B2RXH2 1/20 0.48
▸ PRMT1 Q99873 1/20 0.47
▸ LMNA P02545 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ FAAH O00519 4/20 0.44
▸ CNR1 P21554 2/20 0.43
▸ CNR2 P34972 2/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SLC6A5 Q9Y345 1/20 0.42
▸ DNM1 Q05193 1/20 0.41
▸ HDAC3 O15379 1/20 0.41
▸ HDAC4 P56524 1/20 0.41
▸ HDAC1 Q13547 1/20 0.41
▸ HDAC7 Q8WUI4 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
SCHEMBL16799464 1.00 ADRA1A (0.53) ADRA1AEPHX2PLA2G2APLA2G4AKDM4E
SCHEMBL16799405 1.00 ADRA1A (0.53) ADRA1AEPHX2PLA2G2APLA2G4AKDM4E
SCHEMBL16798840 1.00 ADRA1A (0.53) ADRA1AEPHX2PLA2G2APLA2G4AKDM4E
SCHEMBL16798851 0.98 ADRA1A (0.50) ADRA1AEPHX2PLA2G2APLA2G4AKDM4E
SCHEMBL16799467 0.95 TSHR (0.50) ADRA1AEPHX2PLA2G2APLA2G4AKDM4E
SCHEMBL16309303 0.91 FAAH (0.46) EPHX2TSHRFAAHMEN1KMT2A
SCHEMBL1173562 0.90 ADRA1A (0.66) ADRA1AEPHX2PLA2G2APLA2G4AKDM4E
SCHEMBL1333097 0.90 ADRA1A (0.66) ADRA1AEPHX2PLA2G2APLA2G4AKDM4E
SCHEMBL907297 0.90 ADRA1A (0.66) ADRA1AEPHX2PLA2G2APLA2G4AKDM4E
SCHEMBL21099597 0.90 ADRA1A (0.66) ADRA1AEPHX2PLA2G2APLA2G4AKDM4E

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3077476-B1 NANOCRYSTALS COMPLEXED WITH FUNCTIONALIZABLE ENHANCED AFFINITY LIGANDS AND USE THEREOF NEXDOT (FR) 2020-02-12 — — EP disclosed
US-10465030-B2 Nanoparticles complexed with functionalizable enhanced affinity ligands and use thereof NEXDOT (FR) 2019-11-05 — — US disclosed
US-20160304648-A1 NANOPARTICLES COMPLEXED WITH FUNCTIONALIZABLE ENHANCED AFFINITY LIGANDS AND USE THEREOF NEXDOT (FR) 2016-10-20 — — US disclosed
EP-3077476-A1 NANOPARTICLES COMPLEXED WITH FUNCTIONALIZABLE ENHANCED AFFINITY LIGANDS AND USE THEREOF Nexdot (FR) 2016-10-12 — — EP disclosed
WO-2015082656-A1 NANOPARTICLES COMPLEXED WITH FUNCTIONALIZABLE ENHANCED AFFINITY LIGANDS AND USE THEREOF NEXDOT (FR) 2015-06-11 — — WO disclosed
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