SCHEMBL5715539

SCHEMBL5715539

CCCCCCCCCNCCCCCCCCC.Fc1ccccc1-c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
SIGMAR1 Q99720 1/20 0.46
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
GCGR P47871 1/20 0.40
ASAH1 Q13510 1/20 0.38
ACHE P22303 4/20 0.38
TLR8 Q9NR97 1/20 0.37
EPHX2 P34913 1/20 0.37
HRH4 Q9H3N8 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
NAAA Q02083 1/20 0.36
LMNA P02545 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 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
SCHEMBL5716039 1.00 MEN1 (0.48) MEN1KMT2ASMN1; SMN2SIGMAR1ALDH1A1
SCHEMBL5716103 0.94 SMN1; SMN2 (0.46) MEN1KMT2ASMN1; SMN2SIGMAR1TSHR
SCHEMBL5715754 0.94 SMN1; SMN2 (0.46) MEN1KMT2ASMN1; SMN2SIGMAR1TSHR
SCHEMBL5716567 0.93 SMN1; SMN2 (0.45) MEN1KMT2ASMN1; SMN2SIGMAR1GCGR
SCHEMBL5715595 0.87 ADORA2A (0.35) SMN1; SMN2ALDH1A1GCGRHDAC3HDAC1
SCHEMBL5716247 0.81 EPHX2 (0.46) MEN1KMT2ASMN1; SMN2SIGMAR1ALDH1A1
SCHEMBL5716342 0.81 GCGR (0.40) MEN1KMT2ASMN1; SMN2ALDH1A1GCGR
SCHEMBL5716203 0.81 ADRB2 (0.36) SMN1; SMN2ALDH1A1GCGRHDAC3HDAC1
SCHEMBL5716446 0.80 EPHX2 (0.45) MEN1KMT2ASMN1; SMN2SIGMAR1ALDH1A1
SCHEMBL5716118 0.79 TSHR (0.59) MEN1KMT2ASMN1; SMN2SIGMAR1ALDH1A1

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-1661900-A1 Olefin polymerization cocatalysts derived from group-15 cationic compounds and processes using them ExxonMobil Chemical Patents Inc. (US) 2006-05-31 EP disclosed
EP-1252166-B1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 CATIONIC COMPOUNDS AND PROCESSES USING THEM EXXONMOBIL CHEM PATENTS INC (US) 2005-11-09 EP disclosed