SCHEMBL285402

SCHEMBL285402

[c]1cccc2c3c(ccc12)-c1ccccc1C3

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA4 P22748 2/20 0.40
CA6 P23280 2/20 0.40
PNMT P11086 1/20 0.40
PGR P06401 1/20 0.38
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 1/20 0.36
HPGD P15428 1/20 0.36
ACHE P22303 3/20 0.36
BCHE P06276 3/20 0.36
HTR7 P34969 2/20 0.33
HTR2B P41595 2/20 0.33
MAOA P21397 1/20 0.33
SRD5A2 P31213 1/20 0.33

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
SCHEMBL10484429 0.79 CA1 (0.42) CA1CA2CA4CA6PNMT
SCHEMBL29216529 0.77 MAOA (0.37) CA1CA2CA4CA6NPC1
SCHEMBL4849522 0.76 PNMT (0.52) CA1CA2CA4CA6PNMT
SCHEMBL814655 0.73 PNMT (0.40) CA1CA2CA4CA6PNMT
SCHEMBL22263591 0.73 PNMT (0.57) CA1CA2CA4CA6PNMT
SCHEMBL815143 0.73 MAOA (0.34) CA1CA2CA4CA6NPC1
Benzo(A)Fluorene SCHEMBL29620372 0.73 CA1 (0.46) CA1CA2CA4CA6PNMT
Benzo(A)Fluorene SCHEMBL29432662 0.73 CA1 (0.46) CA1CA2CA4CA6PNMT
Benzo(A)Fluorene SCHEMBL150250 0.73 CA1 (0.46) CA1CA2CA4CA6PNMT
Benzo(A)Fluorene SCHEMBL29413802 0.73 CA1 (0.46) CA1CA2CA4CA6PNMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021119089-A1 PROCESSES FOR INTRODUCTION OF LIQUID ACTIVATORS IN OLEFIN POLYMERIZATION REACTIONS EXXONMOBIL CHEMICAL PATENTS INC. (US) 2021-06-17 WO disclosed
EP-2427504-A1 SYSTEMS AND METHODS FOR MONITORING A POLYMERIZATION REACTION Univation Technologies, LLC (US) 2012-03-14 EP disclosed
WO-2010129634-A1 SYSTEMS AND METHODS FOR MONITORING A POLYMERIZATION REACTION UNIVATION TECHNOLOGIES, LLC (US) 2010-11-11 WO disclosed