SCHEMBL29459245

SCHEMBL29459245

Cc1ccc(C2=Cc3c(cc4c(c3-c3ccccc3)CCC4)C2)o1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
ALOX15 P16050 2/20 0.32
KMT2A Q03164 2/20 0.32
HSD17B10 Q99714 2/20 0.32
POLB P06746 1/20 0.32
PPARG P37231 1/20 0.32
RECQL P46063 1/20 0.32
BLM P54132 1/20 0.32
MCL1 Q07820 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
NR2E3 Q9Y5X4 1/20 0.32
NCOR2 Q9Y618 1/20 0.32
ADORA2A P29274 1/20 0.31

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
SCHEMBL29459301 0.89 BCHE (0.33)
SCHEMBL29459146 0.84
SCHEMBL18393569 0.84 PTGS1 (0.40) PTGS1PTGS2KDM4EMEN1ALDH1A1
SCHEMBL15712971 0.83 PTGS1 (0.40) PTGS1PTGS2KDM4EMEN1ALDH1A1
SCHEMBL29459310 0.81 ALOX5 (0.40) PTGS1PTGS2KDM4EMEN1ALDH1A1
SCHEMBL2239872 0.80 PTGS1 (0.42) PTGS1PTGS2KDM4EMEN1ALDH1A1
SCHEMBL29596409 0.80 BRD4 (0.35) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL3697443 0.80 BRD4 (0.35) KDM4EMEN1ALDH1A1MAPTHPGD
SCHEMBL18393559 0.79 PTGS1 (0.37) PTGS1PTGS2KDM4EMEN1ALDH1A1
Lithium SCHEMBL29767634 0.79 BRD4 (0.35) KDM4EMEN1ALDH1A1MAPTHPGD

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
WO-2022059764-A1 ION-EXCHANGEABLE LAYERED SILICATE SALT PARTICLES, OLEFIN POLYMERIZATION CATALYST COMPONENT, OLEFIN POLYMERIZATION CATALYST, METHOD FOR PRODUCING OLEFIN POLYMERIZATION CATALYST, AND METHOD FOR PRODUCING OLEFIN POLYMER USING SAME 日本ポリプロ株式会社 2022-03-24 WO disclosed
WO-2022059765-A1 METHOD FOR PRODUCING ION-EXCHANGEABLE LAYERED SILICATE SALT PARTICLES, METHOD FOR PRODUCING OLEFIN POLYMERIZATION CATALYST COMPONENT, METHOD FOR PRODUCING OLEFIN POLYMERIZATION CATALYST, AND METHOD FOR PRODUCING OLEFIN POLYMER USING SAME 日本ポリプロ株式会社 2022-03-24 WO disclosed