SCHEMBL5716346

SCHEMBL5716346

CCCC(C)CP(CCC)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
POLB P06746 2/20 0.33
AOC3 Q16853 1/20 0.31
GPR88 Q9GZN0 1/20 0.30
TSHR P16473 1/20 0.30
FFAR1 O14842 1/20 0.30
GPR84 Q9NQS5 1/20 0.30

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
SCHEMBL6794411 0.88 TRPA1 (0.30)
SCHEMBL5716450 0.87 SMN1; SMN2 (0.34) SMN1; SMN2NPC1RAB9APOLBAOC3
SCHEMBL5716020 0.87 MEN1 (0.36) SMN1; SMN2
SCHEMBL301087 0.78 CYP3A4 (0.41) SMN1; SMN2
SCHEMBL6443732 0.77 PRSS1 (0.33)
SCHEMBL6791752 0.77 PRSS1 (0.33)
SCHEMBL1241769 0.76 CYP3A4 (0.39) SMN1; SMN2
SCHEMBL5716520 0.76 TRPA1 (0.31) NPC1RAB9A
SCHEMBL6785461 0.74 TRPA1 (0.30)
SCHEMBL6682714 0.74 CYP3A4 (0.38) SMN1; SMN2

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
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
EP-1252166-A1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 CATIONIC COMPOUNDS AND PROCESSES USING THEM EXXON CHEMICAL PATENTS INC. (US) 2002-10-30 EP disclosed
WO-2001042249-A1 OLEFIN POLYMERIZATION COCATALYSTS DERIVED FROM GROUP-15 COMPOUNDS AND PROCESSES USING THEM EXXON CHEMICAL PATENTS INC. (US) 2001-06-14 WO disclosed