SCHEMBL4189386

SCHEMBL4189386

C#Cc1ccccc1CC(=O)Cc1ccccc1.c1cc2ccc1-2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.43
ABCC4 O15439 1/20 0.43
GAA P10253 1/20 0.43
TSHR P16473 1/20 0.43
PTGS1 P23219 1/20 0.43
HTT P42858 1/20 0.43
SRD5A2 P31213 1/20 0.41
CES1 P23141 2/20 0.40
CES2 O00748 1/20 0.40
AKR1B1 P15121 1/20 0.40
ALDH1A1 P00352 2/20 0.40
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HPGD P15428 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
SCHEMBL2426899 0.92 LMNA (0.37) LMNAABCC4GAATSHRPTGS1
SCHEMBL4210408 0.87 AKR1B1 (0.38) LMNACES1CES2AKR1B1TDP1
SCHEMBL28660181 0.83 AKR1B1 (0.50) LMNAABCC4GAATSHRPTGS1
SCHEMBL3618428 0.78 AKR1B1 (0.55) PTGS1AKR1B1TDP1HPGD
SCHEMBL13586796 0.76 LMNA (0.56) LMNAABCC4GAATSHRPTGS1
SCHEMBL7410335 0.75 LMNA (0.72) LMNAABCC4GAATSHRPTGS1
SCHEMBL11879591 0.73 LMNA (0.75) LMNAABCC4GAATSHRPTGS1
SCHEMBL28668160 0.73 AKR1B1 (0.46) LMNAABCC4GAATSHRPTGS1
SCHEMBL77563 0.73 CES1 (0.70) LMNAABCC4GAATSHRPTGS1
SCHEMBL5326692 0.73 PKM (0.36) LMNAGAAAKR1B1TDP1NPC1

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-1476416-B1 MULTIFUNCTIONAL MONOMERS AND THEIR USE IN MAKING CROSS-LINKED POLYMERS AND POROUS FILMS DOW GLOBAL TECHNOLOGIES LLC (US) 2015-12-30 EP disclosed
US-7635741-B2 Curable polyacetylenes used as dielectrics in making microelectronics such as integrated circuits DOW GLOBAL TECHNOLOGIES INC. 2009-12-22 US disclosed
US-20070037894-A1 Multifunctional menomers and polyarylene compsotions therefrom HAHNFELD JERRY L 2007-02-15 US disclosed
US-20070027280-A1 Multifunctional substituted monomers and polyarylene compositions therefrom HAHNFELD JERRY L 2007-02-01 US disclosed
US-20040053033-A1 Multifunctional monomers and their use in making cross-linked polymers and porous films NIU Q JASON (US) 2004-03-18 US disclosed